Most of molecules enter or leave cells mainly via membrane transport proteins, which play important roles in several cellular functions, including cell metabolism, ion homeostasis, signal transduction, binding with small molecules in extracellular space, the recognition process in the immune system, energy transduction, osmoregulation, and physiological and developmental processes. There are three major types of transport proteins, ATP-powered pumps, channel proteins and transporters.

ATP-powered pumps are ATPases that use the energy of ATP hydrolysis to move ions or small molecules across a membrane against a chemical concentration gradient or electric potential. Channel proteins transport water or specific types of ions down their concentration or electric potential gradients. Many other types of channel proteins are usually closed, and open only in response to specific signals. Because these types of ion channels play a fundamental role in the functioning of nerve cells. Transporters, a third class of membrane transport proteins, move a wide variety of ions and molecules across cell membranes. Membrane transporters either enhance or restrict drug distribution to the target organs. Depending on their main function, these membrane transporters are divided into two categories: the efflux (export) and the influx (uptake) transporters.

Transport proteins such as channels and transporters play important roles in the maintenance of intracellular homeostasis, and mutations in these transport protein genes have been identified in the pathogenesis of a number of hereditary diseases. In the central nervous system ion channels have been linked to many diseases such, but not limited to, ataxias, paralyses, epilepsies, and deafness indicative of the roles of ion channels in the initiation and coordination of movement, sensory perception, and encoding and processing of information. Furthermore, drug transporters can serve as drug targets or as a mechanism to facilitate drug delivery to cells and tissues.

References:
[1] Sadée W, et al. Pharm Res. 1995 Dec;12(12):1823-37.
[2] Girardin F. Dialogues Clin Neurosci. 2006;8(3):311-21.
[3] Zaydman MA, et al. Chem Rev. 2012 Dec 12;112(12):6319-33.
[4] Mishra NK, et al. PLoS One. 2014 Jun 26;9(6):e100278.


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CNS-5161,N'-(2-CHLORO-5-METHYLSULFANYL-PHENYL)-N-METHYL-N-(3-METHYLSULFANYL-PHENYL)-GUANIDINE

CNS-5161 is a novel NMDA ion-channel antagonist that interacts with the NMDA receptor/ion channel site to produce a noncompetitive blockade of the actions of glutamate.

  • CAS Number: 160754-76-7
  • MF: C16H18ClN3S2
  • MW: 351.92
  • Catalog: iGluR
  • Density: 1.25g/cm3
  • Boiling Point: 529.2ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 273.8ºC

Memantine-d3 hydrochloride

Memantine-d3 (hydrochloride) is deuterium labeled Memantine. Memantine is an orally active, noncompetitive N-methyl-D-aspartate receptor (NMDAR) antagonist. Memantine can be used for the research of moderate-to-severe Alzheimer's disease (AD)[1][2][3].

  • CAS Number: 1329802-06-3
  • MF: C12H19D3ClN
  • MW: 218.78
  • Catalog: iGluR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Procyclidine hydrochloride

Procyclidine hydrochloride is a potent anti-cholinergic agent, and is also known to have NMDA antagonist properties.

  • CAS Number: 1508-76-5
  • MF: C19H30ClNO
  • MW: 323.90100
  • Catalog: iGluR
  • Density: N/A
  • Boiling Point: 433.5ºC at 760 mmHg
  • Melting Point: 85.5 to 86.5ºC
  • Flash Point: 205.7ºC

Pyr10

Pyr10is a novel TRPC3-selective inhibitor, IC50 of Ca2+ influx inhibition by Pyr10 in carbachol-stimulated YFP-TRPC3-transfected HEK293 cells for ROCE and thapsigargin-depleted native RBL-2H3 cells for SOCE is 0.72 uM and 13.08 uM.IC50 value: 0.72 uM (TRPC3-ROCE), 13.08 uM (SOCE) [1]Target: TRPC3in vitro: Pyr10 displays substantial selectivity for TRPC3-mediated responses (18-fold) and the selective block of TRPC3 channels by Pyr10 barely affected mast cell activation.[1]

  • CAS Number: 1315323-00-2
  • MF: C18H13F6N3O2S
  • MW: 449.370
  • Catalog: TRP Channel
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 470.1±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 238.1±31.5 °C

DNQX

DNQX is a AMPA receptor antagonists.target: AMPA receptorIn vitro: DNQX, added 2 h after cell plating, induces a dose-dependent neurotoxicity.

  • CAS Number: 2379-57-9
  • MF: C8H4N4O6
  • MW: 252.141
  • Catalog: iGluR
  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 670.7ºC at 760 mmHg
  • Melting Point: >300°C
  • Flash Point: 359.4ºC

Glycine-d5

Glycine-d5 is the deuterium labeled Glycine. Glycine is an inhibitory neurotransmitter in the CNS and also acts as a co-agonist along with glutamate, facilitating an excitatory potential at the glutaminergic N-methyl-D-aspartic acid (NMDA) receptors.

  • CAS Number: 4896-77-9
  • MF: C2D5NO2
  • MW: 80.097
  • Catalog: iGluR
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 240.9±23.0 °C at 760 mmHg
  • Melting Point: 240ºC (dec.)(lit.)
  • Flash Point: 99.5±22.6 °C

MPC1304

MPC1304 is a Ca2+ channel antagonist with potent and long-lasting antihypertensive effects.

  • CAS Number: 86780-90-7
  • MF: C19H20N2O7
  • MW: 388.37100
  • Catalog: Calcium Channel
  • Density: 1.284 g/cm3
  • Boiling Point: 530ºC at 760 mmHg
  • Melting Point: 155°
  • Flash Point: 274.3ºC

TRPM8 antagonist 3

TRPM8 antagonist 3 is a novel TRPM8 blocker with an IC50 value of 11 nM.

  • CAS Number: 2102179-29-1
  • MF: C13H12N2O4S
  • MW: 292.31
  • Catalog: TRP Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KS 176

KS176 is a potent and selective inhibitor of the breast cancer resistance protein (BCRP) multidrug transporter (IC50 values are 0.59 and 1.39 μM in Pheo A and Hoechst 33342 assays respectively). Displays no inhibitory activity against P-gp or MRP1.IC50 value: 0.59( in Pheo A assay), 1.39 μM (in Hoechst 33342 assay).Target: BCRPThe more detailed information please refer to Compound 9 in the reference.

  • CAS Number: 1253452-78-6
  • MF: C22H19N3O5
  • MW: 405.40300
  • Catalog: BCRP
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MPO-IN-5

MPO-IN-5 (compound 1) is a potent, irreversible MPO (myeloperoxidase) inhibitor. MPO-IN-5 inhibits MPO peroxidation and hERG binding, with IC50 values of 0.22 and 2.8 μM, respectively. MPO-IN-5 shows rapid kinetics of inhibition, with enzyme inactivation rate (kinact/Ki) of 23000 M−1s−1[1].

  • CAS Number: 2476764-11-9
  • MF: C24H24N6O2
  • MW: 428.49
  • Catalog: Potassium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MG 624

MG624 is a potent and selective neuronal α7 nAChR antagonist with a Ki of 106 nM[1].

  • CAS Number: 77257-42-2
  • MF: C22H30NO+
  • MW: 324.48000
  • Catalog: nAChR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Catharanthine Tartrate

Catharanthine Tartrate is an alkaloid isolated from Madagascar periwinkle, inhibits voltage-operated L-type Ca2+ channel, with anti-cancer and blood pressure-lowering activity[1].

  • CAS Number: 4168-17-6
  • MF: C46H54N4O10
  • MW: 822.942
  • Catalog: Calcium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CA 1001

Calcium ionophore I (ETH 1001) is a selective Ca2+ ionophore for biological membranes. Calcium ionophore I can be used in Ca2+-selective microelectrodes that can be used for quantitative intracellular measurements of resting Ca2+-activities and of slowly changing Ca2+-levels[1][2].

  • CAS Number: 58801-34-6
  • MF: C38H72N2O8
  • MW: 684.98700
  • Catalog: Calcium Channel
  • Density: 1g/cm3
  • Boiling Point: 715.1ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 386.3ºC

Lidocaine

Lidocaine, an amide local anesthetic, has anti-inflammatory properties in vitro and in vivo, possibly due to an attenuation of pro-inflammatory cytokines, intracellular adhesion molecule-1 (ICAM-1), and reduction of neutrophils influx.Target: Lidocaine is a common local anesthetic and antiarrhythmic drug. Lidocaine is used topically to relieve itching, burning and pain from skin inflammations, injected as a dental anesthetic or as a local anesthetic for minor surgery. Lidocaine, the first amino amide–type local anesthetic, was first synthesized under the name xylocaine by Swedish chemist Nils Lofgren in 1943. His colleague Bengt Lundqvist performed the first injection anesthesia experiments on himself.Lidocaine is approximately 95% metabolized (dealkylated) in the liver by CYP3A4 to the pharmacologically-active metabolites monoethylglycinexylidide (MEGX) and then subsequently to the inactive glycine xylidide. MEGX has a longer half life than lidocaine but also is a less potent sodium channel blocker. The elimination half-life of lidocaine is approximately 90–120 minutes in most patients. This may be prolonged in patients with hepatic impairment (average 343 minutes) or congestive heart failure (average 136 minutes).

  • CAS Number: 137-58-6
  • MF: C14H22N2O
  • MW: 234.337
  • Catalog: Apoptosis
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 372.7±52.0 °C at 760 mmHg
  • Melting Point: 66-69°C
  • Flash Point: 179.2±30.7 °C

3-chloro-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide

GluR6 antagonist-1 is a benzothiophene derivative, acting as a GluR6 antagonist. GluR6 antagonist-1 can be used for researching acute and chronic neurological disorders[1].

  • CAS Number: 323176-64-3
  • MF: C15H11ClN2OS
  • MW: 302.779
  • Catalog: iGluR
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 543.5±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 282.5±30.1 °C

Oxypeucedanin

Oxypeucedanin is a furocoumarin derivative isolated from Angelica dahurica. Oxypeucedanin is a selective open-channel blocker, inhibits the hKv1.5 current with an IC50 value of 76 nM. Oxypeucedanin prolongs cardiac action potential duration (APD), is a potential antiarrhythmic agent for atrial fibrillation[1]. Oxypeucedanin induces cell apoptosis through inhibition of cancer cell migration[2].

  • CAS Number: 737-52-0
  • MF: C16H14O5
  • MW: 286.279
  • Catalog: Potassium Channel
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 469.6±45.0 °C at 760 mmHg
  • Melting Point: 141-142 °C
  • Flash Point: 237.8±28.7 °C

Facinicline hydrochloride

Facinicline hydrochloride (RG3487 hydrochloride) is an orally active nicotinic α7 receptor partial agonist, with a Ki of 6 nM for α7 human nAChR. Facinicline hydrochloride (RG3487 hydrochloride) improves cognition and sensorimotor gating in rodents. Facinicline hydrochloride (RG3487 hydrochloride) shows high affinity (antagonist) to 5-HT3Rs with a Ki value of 1.2 nM[1].

  • CAS Number: 677305-02-1
  • MF: C15H19ClN4O
  • MW: 306.79
  • Catalog: 5-HT Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PF-04958242

PF-04958242 is a novel potent, selctive, and orally-active AMPA receptor (AMPAR) positive allosteric modulator (PAM) with Ki of 170 nM, EC50 of 370 nM; is under development for the treatment of cognitive symptoms in schizophrenia. Schizophrenia Phase 1 Discontinued

  • CAS Number: 1258963-59-5
  • MF: C18H20N2O4S2
  • MW: 381.509
  • Catalog: iGluR
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 531.0±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 275.0±32.9 °C

Kv3 modulator 1

Kv3 modulator 1 is a Kv3 voltage-gated potassium channel modulator extracted from patent WO2018020263A1, Compound X. Kv3 modulator 1 can be used to treat inflammatory pain[1].

  • CAS Number: 1380696-64-9
  • MF: C20H20N4O4
  • MW: 380.40
  • Catalog: Potassium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Dofequidar

Dofequidar(MS-209) is a novel quinoline compound, which can reverse P-glycoprotein (P-gp)-mediated MDR.IC50 value: Target: P-gpin vitro: MS-209 at 3 microM effectively overcame docetaxel resistance in MDR cancer cells, and this concentration was achieved in blood plasma for > 7 h without serious toxicity [1]. MS-209 restored chemosensitivity of SBC-3 / ADM cells to VP-16, ADM, and VCR in a dose-dependent manner in vitro [2]. MS-209 strongly reversed drug resistance to adriamycin (ADM) and vincristine (VCR) in acquired MDR tumor cell lines, 2780AD and KB-C1. In addition, MS-209 enhanced the cytotoxic effect of ADM and VCR on various human and murine cell lines. Particularly in 4-1St cells, which are extremely resistant to ADM and VCR, MS-209 at a concentration of 3 microM enhanced the cytotoxicity of ADM and VCR, 88- and 350-fold, respectively [3].in vivo: Treatment with docetaxel alone at the maximal tolerated dose (MTD) showed an apparent antitumor activity to an intrinsically resistant HCT-15 tumor xenograft, and MS-209 additionally potentiated the antitumor activity of docetaxel. Against a MCF-7/ADM tumor xenograft expressing larger amounts of P-gp, docetaxel alone at the MTD showed no antitumor activity, whereas the MTD of docetaxel combined with MS-209 greatly reduced MCF-7/ADM tumor growth [1]. Intravenous injection with SBC-3 or SBC-3 / ADM cells produced metastatic colonies in the liver, kidneys and lymph nodes in natural killer (NK) cell-depleted severe combined immunodeficiency (SCID) mice, though SBC-3 / ADM cells more rapidly produced metastases than did SBC-3 cells. Treatment with VP-16 and ADM reduced metastasis formation by SBC-3 cells, whereas the same treatment did not affect metastasis by SBC-3 / ADM cells. Although MS-209 alone had no effect on metastasis by SBC-3 or SBC-3 / ADM cells, combined use of MS-209 with VP-16 or ADM resulted in marked inhibition of metastasis formation by SBC-3 / ADM cells to multiple organs [2]. MS-209 administered orally, together with ADM, enhanced the antitumor activity of ADM on Colon 26 and 4-1St tumors implanted subcutaneously (SC) in mice; the antitumor effect of ADM plus MS-209 was higher than that of ADM alone at the maximum tolerated dose (MTD) [3].

  • CAS Number: 129716-58-1
  • MF: C30H31N3O3
  • MW: 481.58500
  • Catalog: P-glycoprotein
  • Density: 1.228g/cm3
  • Boiling Point: 720.8ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 389.7ºC

bifenthrin

Bifenthrin is a synthetic pyrethroid insecticide that prolongs opening of sodium channels resulting in membrane depolarization and conductance block in the insect nervous system. Bifenthrin is effective against A. gambiae and C. quinquefasciatus mosquitos (LD50s = 0.15 and 0.16 ng/mg, respectively) and increases O. insidiosus mortality in treated corn and sorghum plants.

  • CAS Number: 82657-04-3
  • MF: C23H22ClF3O2
  • MW: 422.868
  • Catalog: Sodium Channel
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 453.2±45.0 °C at 760 mmHg
  • Melting Point: 68-71°C
  • Flash Point: 136.5±17.9 °C

Eleclazine hydrochloride

Eleclazine hydrochloride is a novel late Na+ current inhibitor with IC50 value of 0.7 uM. target: Na+ current.IC50: 0.7 uM.In vitro: Eleclazine hydrochloride inhibits ATX-II enhanced late INa in ventricular myocytes, shorten the ATX-II induced prolongation of APD, MAPD, QT interval, and decreased spatiotemporal dispersion of repolarization and ventricular arrhythmias. Inhibition by GS-6615 of ATX-II enhanced late INa is strongly correlated with shortening of myocyte APD and isolated heart MAPD[1]. Selective inhibition of cardiac late INa with eleclazine hydrochloride confers dual protection against vulnerability to ischemia-induced AF and reduces atrial and ventricular repolarization abnormalities before and during adrenergic stimulation without negative inotropic effects. [2]

  • CAS Number: 1448754-43-5
  • MF: C21H17ClF3N3O3
  • MW: 451.826
  • Catalog: Sodium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KC 12291 hydrochloride

KC 12291 hydrochloride is an orally active blocker of voltage-gated sodium channel (VGSC). KC 12291 hydrochloride reduces the amplitude of sustained Na+ current to exert antiischemic activity. KC 12291 hydrochloride has significant cardioprotective effect in vitro and in vivo[1].

  • CAS Number: 181936-98-1
  • MF: C22H28ClN3O3S
  • MW: 449.99
  • Catalog: Sodium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

U-101017

U-101017 is a partial agonist of benzodiazepine receptor and GABAA receptor, with anxiolytic effects. 

  • CAS Number: 170568-47-5
  • MF: C23H27ClN4O3
  • MW: 442.93800
  • Catalog: GABA Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

KPT-8602

KPT-8602 is a second-generation exportin-1 inhibitor, shows similar in vitro potency compared with KPT-330.In vitro: KPT-8602 induces caspase-dependent apoptosis in a panel of leukemic cell lines in vitro. Using CRISPR/Cas9 genome editing we demonstrats the specificity of KPT-8602 for cysteine 528 in the cargo-binding groove of XPO1 and validats the drug target interaction. [1]In vivo: KPT-8602 shows potent anti-leukemia activity in a mouse ALL model as well as in patient-derived T- and B-ALL xenograft models without affecting normal hematopoiesis.[1]

  • CAS Number: 1642300-52-4
  • MF: C17H10F6N6O
  • MW: 428.291
  • Catalog: CRM1
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 574.4±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 301.2±32.9 °C

AMG2850

AMG2850 is a potent, orally bioavailable and selective transient receptor potential melastatin 8 (TRPM8) antagonist[1].

  • CAS Number: 1470018-52-0
  • MF: C19H17F6N3O
  • MW: 417.35
  • Catalog: TRP Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

L-Ascorbic acid-13C-2

L-Ascorbic acid-13C-2 is the 13C labeled L-Ascorbic acid. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen

  • CAS Number: 1313730-17-4
  • MF: C513CH8O6
  • MW: 177.12
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

JYL1421

JYL 1421 is a TRPV1 receptor antagonist, with an IC50 of 8 nM.

  • CAS Number: 401907-26-4
  • MF: C20H26FN3O2S2
  • MW: 423.568
  • Catalog: TRP Channel
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 546.6±60.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 284.4±32.9 °C

BI-9627

BI-9627 is a sodium−hydrogen exchanger isoform 1 (NHE1) inhibitor with an EC50 of 31 nM[1].

  • CAS Number: 1204329-34-9
  • MF: C16H19F3N4O2
  • MW: 356.34
  • Catalog: Sodium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

MC-70

MC70 is a potent and non-selective P-glycoprotein (P-gp) inhibitor with an EC50 of 0.69 µM. MC70 is an ABC transporters inhibitor and anticancer agent. MC70 interacts with ABCB1, ABCG2 and ABCC1[1][2].

  • CAS Number: 1031367-64-2
  • MF: C24H25NO3
  • MW: 375.46
  • Catalog: P-glycoprotein
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 536.6±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 278.3±30.1 °C