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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NS 5806

NS5806, a potent potassium current activator, increases KV4.3/KChIP2 peak current amplitudes with an EC50 of 5.3 μM. NS5806 slows KV4.3 and KV4.2 current dacay in channel complexes containing KChIP2[1].

  • CAS Number: 426834-69-7
  • MF: C16H8Br2F6N6O
  • MW: 574.07300
  • Catalog: Potassium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Ivacaftor-d18

Ivacaftor-d18 is the deuterium labeled Ivacaftor[1]. Ivacaftor (VX-770) is a potent and orally bioavailable CFTR potentiator, targeting G551D-CFTR and F508del-CFTR with EC50s of 100 nM and 25 nM, respectively[2].

  • CAS Number: 1413431-05-6
  • MF: C24H10D18N2O3
  • MW: 410.60200
  • Catalog: Autophagy
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Articaine

Articaine (Hoe-045 free base) is an amide anaesthetic containing an ester group, reversibly binding to the α-subunit of the voltage-gated sodium channels within the inner cavity of the nerve, can provide effective pain relief. Articaine ameliorates LPS-induced acute kidney injury via inhibition of NF-ĸB activation and the NLRP3 inflammasome pathway[1][2][3].

  • CAS Number: 23964-58-1
  • MF: C13H20N2O3S
  • MW: 284.37500
  • Catalog: NOD-like Receptor (NLR)
  • Density: 1.178 g/cm3
  • Boiling Point: 440.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 220.3ºC

N-methylcytisine

N-Methylcytisine (Caulophylline), a tricyclic quinolizidine alkaloid, exerts hypoglycaemic, analgesic and anti-inflammatory activities. N-methylcytisine is a selective ligand of nicotinic receptors of acetylcholine in the central nervous system and has a high affinity (Kd = 50 nM) to nicotinic acetylcholine receptors (nAChR) from squid optical ganglia[1][2].

  • CAS Number: 486-86-2
  • MF: C12H16N2O
  • MW: 204.27
  • Catalog: nAChR
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 400.8±34.0 °C at 760 mmHg
  • Melting Point: 137-139ºC
  • Flash Point: 191.9±18.0 °C

GNE-616

GNE-616 is a highly potent, metabolically stable, orally bioavailable, and subtype selective Nav1.7 inhibitor (Ki of 0.79 nM and Kd of 0.38 nM for hNav1.7) for the treatment of chronic pain. GNE-616 shows >1000 nM Kd and >2500-fold selectivity over hNav1.1, hNav1.3, hNav1.4, and hNav1.5. Selectivity over hNav1.2 and hNav1.6 is more modest at 31- and 73-fold, respectively[1].

  • CAS Number: 2349371-81-7
  • MF: C24H23F4N5O3S
  • MW: 537.53
  • Catalog: Sodium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

SSR 180711 hydrochloride

SSR180711 hydrochloride is an orally active, selective and reversible α7 acetylcholine nicotinic receptor (n-AChRs) partial agonist. SSR180711 hydrochloride can act on rat α7 n-AChR (Ki=22 nM; IC50=30 nM) and human α7 n-AChR (Ki=14 nM; IC50=18 nM). SSR180711 hydrochloride increases glutamatergic neurotransmission, ACh release and long-term potentiation (LTP) in the hippocampus[1].

  • CAS Number: 446031-79-4
  • MF: C14H18BrClN2O2
  • MW: 361.66
  • Catalog: nAChR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PGP 4008

PGP-4008 is a specific P-glycoprotein (Pgp) inhibitor. PGP-4008 inhibits tumor growth in a murine syngeneic Pgp-mediated multiple drug resistance (MDR) solid tumor model when given in combination with Doxorubicin[1].

  • CAS Number: 365565-02-2
  • MF: C26H23N3O
  • MW: 393.48000
  • Catalog: P-glycoprotein
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

IBUTILIDE

Ibutilide (U70226E free base), an action potential-prolonging antiarrhythmic, is a potent blocker of the rapidly activating delayed rectifier K+ current (IKr) in AT-1 cells[1].

  • CAS Number: 122647-31-8
  • MF: C20H36N2O3S
  • MW: 384.57600
  • Catalog: Potassium Channel
  • Density: 1.099g/cm3
  • Boiling Point: 522.4ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 269.7ºC

broflanilide

Broflanilide is a potential insecticide and metabolized to desmethyl-broflanilide, which is a potent antagonist at the insect resistant-to-dieldrin (RDL) GABA receptor, and inhibits S. litura RDL GABAR, with an IC50 value of 1.3 nM.

  • CAS Number: 1207727-04-5
  • MF: C25H14BrF11N2O2
  • MW: 663.277
  • Catalog: GABA Receptor
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 467.9±45.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 236.8±28.7 °C

(+)-TUBOCURARINE CHLORIDE PENTAHYDRATE

D-Tubocurarine chloride pentahydrate is the chloride salt form of Tubocurarine, a nicotinic acetylcholine receptors (AChR) antagonist, and can be used as a skeletal muscle relaxant during surgery or mechanical ventilation. D-Tubocurarine chloride pentahydrate is also a potent neuromuscular blocking agent[1][2][3].

  • CAS Number: 6989-98-6
  • MF: C37H52Cl2N2O11
  • MW: 771.72200
  • Catalog: nAChR
  • Density: 1.2074 (rough estimate)
  • Boiling Point: N/A
  • Melting Point: 275-280ºC (dec.)(lit.)
  • Flash Point: N/A

NF023

NF023 hexasodium is a selective and competitive P2X1 receptor antagonist, with IC50 values of 0.21 μM, 28.9 μM, > 50 μM and > 100 μM for human P2X1, P2X3, P2X2, and P2X4-mediated responses respectively[1][2][3][4].

  • CAS Number: 104869-31-0
  • MF: C35H20N4Na6O21S6
  • MW: 1162.88000
  • Catalog: P2X Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bevantolol hydrochloride

Bevantolol hydrochloride is a selective β1 and α1-adrenergic receptor antagonist with pKi values of 7.83, 6.9 in rat cerebral cortex, respectively. Bevantolol hydrochloride is a potent Ca2+ antagonist[1][2].

  • CAS Number: 42864-78-8
  • MF: C20H28ClNO4
  • MW: 381.894
  • Catalog: Adrenergic Receptor
  • Density: N/A
  • Boiling Point: 518.3°C
  • Melting Point: N/A
  • Flash Point: N/A

AM 0902

AM-0902 is a potent, selective transient receptor potential A1 (TRPA1) antagonist with IC50s of 71 and 131 nM for rTRPA1 and hTRPA1, respectively.

  • CAS Number: 1883711-97-4
  • MF: C17H15ClN6O2
  • MW: 370.79
  • Catalog: TRP Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Benzocaine

Benzocaine shares a common receptor with all other local anesthetics (LAs) in the voltage-gated Na+ channel, with an IC50 of 0.8 mM tested with a potential of +30 mV.

  • CAS Number: 94-09-7
  • MF: C9H11NO2
  • MW: 165.189
  • Catalog: JAK
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 310.7±15.0 °C at 760 mmHg
  • Melting Point: 88-90 °C
  • Flash Point: 164.2±17.9 °C

DPX-JW062

Indoxacarb ((±)-Indoxacarb) is a broad-spectrum oxadiazine insecticide. Indoxacarb is metabolized in vivo to its active N-decarbomethoxyllated metabolite DCJW. Indoxacarb suppresses voltage-gated sodium channel currents in rat dorsal root ganglion neurons.

  • CAS Number: 144171-61-9
  • MF: C22H17ClF3N3O7
  • MW: 527.834
  • Catalog: Sodium Channel
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 571.4±60.0 °C at 760 mmHg
  • Melting Point: 139-141ºC
  • Flash Point: 299.3±32.9 °C

ω-Conotoxin SO3

ω-Conotoxin SO3 is a blocker of N-type voltage-sensitive calcium channel. ω-Conotoxin SO3 is an analgesicω-conotoxin that can be isolated from the venom of C. striatus[1][2].

  • CAS Number: 441284-32-8
  • MF: C100H166N36O31S6
  • MW: 2561.00
  • Catalog: Calcium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

8-Bromo-ATP

8-Bromo-ATP (8-Bromoadenosine 5'-triphosphate), an ATP analogue, is a purinergic P2X receptor agonist. 8-Bromo-ATP shows cytotoxic to multiple myeloma cells with an IC50 of 23.1 μM[1][2][3].

  • CAS Number: 23567-97-7
  • MF: C10H15BrN5O13P3
  • MW: 586.07700
  • Catalog: P2X Receptor
  • Density: 2.85g/cm3
  • Boiling Point: 1009.7ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 564.5ºC

Roemerine

Roemerine, an aporphine alkaloid, isolated from the leaves of Annona senegalensis, functions by interacting with P-glycoprotein. Roemerine reverses the multidrug-resistance phenotype with cultured cells[1].

  • CAS Number: 548-08-3
  • MF: C18H17NO2
  • MW: 279.33300
  • Catalog: P-glycoprotein
  • Density: 1.269±0.06 g/cm3 (20 ºC 760 Torr)
  • Boiling Point: N/A
  • Melting Point: 102-103 ºC
  • Flash Point: N/A

bPiDDB

bPiDDB is a potent nAChR antagonist. bPiDDB potently (IC50=2 nM) inhibits nicotine-evoked striatal dopamine (DA) release through an interaction with α6β2-containing nAChRs[1].

  • CAS Number: 525596-66-1
  • MF: C24H38Br2N2
  • MW: 514.38000
  • Catalog: nAChR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BL 1249

BL-1249 is a nonsteroidal anti-inflammatory drug (NSAID) and a potassium channel activator. BL-1249 potently activates K2P2.1 (TREK-1) and K2P10.1 (TREK-2) with EC50 values of 5.5 μM and 8.0 μM, respectively. BL-1249 extracellular application activates all TREK subfamily members but has no effect on other K2P subfamilies. BL-1249 exhibits more selective for the bladder (EC50 of 1.26 μM) than vascular tissue (EC50 of 21.0 μM)[1][2].

  • CAS Number: 18200-13-0
  • MF: C17H17N5
  • MW: 291.35000
  • Catalog: Potassium Channel
  • Density: 1.291g/cm3
  • Boiling Point: 492.6ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 251.7ºC

HER2-IN-13

HER2-IN-13 (Compound 33) is an HER2 inhibitor with an IC50 of 8 nM. HER2-IN-13 also inhibits wt-EGFR with an IC50 of 0.40 μM[1].

  • CAS Number: 2414056-34-9
  • MF: C26H23ClF2N8O3
  • MW: 568.96
  • Catalog: EGFR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Anticancer agent 50

Anticancer agent 50 (compound 6) is a potent ABCB1 efflux pump modulator. Anticancer agent 50 shows cytotoxic effects and antiproliferative effects. Anticancer agent 50 decreases the expression of cyclin D1 and induces p53 expression. Anticancer agent 50 has the potential for the research of T-lymphoma[1].

  • CAS Number: 2487457-15-6
  • MF: C30H32N2O4Se
  • MW: 563.55
  • Catalog: MDM-2/p53
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

DL-TBOA

DL-TBOA is a potent non-transportable inhibitor of excitatory amino acid transporters with IC50s of 70 μM, 6 μM and 6 μM for excitatory amino acid transporter-1 (EAAT1), EAAT2 and EAAT3, respectively. DL-TBOA inhibits the uptake of [14C]glutamate in COS-1 cells expressing the human EAAT1 and EAAT2 with Ki valuesof 42 μM and 5.7 μM, respectively. DL-TBOA blocks EAAT4 and EAAT5 in a competitive manner with Ki values of 4.4 μM and 3.2 μM, respectively[1][2][3].

  • CAS Number: 205309-81-5
  • MF: C11H13NO5
  • MW: 478.449
  • Catalog: EAAT2
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Aminooxyacetic acid hemihydrochloride

Aminooxyacetic acid hemihydrochloride is a malate-aspartate shuttle (MAS) inhibitor which also inhibits the GABA degradating enzyme GABA-T.

  • CAS Number: 2921-14-4
  • MF: NH2OCH2COOH·0.5HCl
  • MW: 109.30
  • Catalog: GABA Receptor
  • Density: N/A
  • Boiling Point: 326.7ºC at 760 mmHg
  • Melting Point: 156 °C (dec.)(lit.)
  • Flash Point: 151.4ºC

α-Cyano-4-hydroxycinnamic acid

α-Cyano-4-hydroxycinnamic acid (α-Cyano-4-hydroxycinnamate) is a potent and non-competitive inhibitor of monocarboxylate transporters (MCTs). α-Cyano-4-hydroxycinnamic acid inhibits mitochondrial pyruvate transporter with a Ki of 6.3 μM. α-Cyano-4-hydroxycinnamic acid is used as a matrix to facilitate peptide ionization in matrix-assisted laser desorption/ionization time-of-flight (MALDI-TOF) mass spectrometry applications[1][2].

  • CAS Number: 28166-41-8
  • MF: C10H7NO3
  • MW: 189.167
  • Catalog: Monocarboxylate Transporter
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 398.1±32.0 °C at 760 mmHg
  • Melting Point: 245-250 °C(lit.)
  • Flash Point: 194.5±25.1 °C

Gabapentin-d6 hydrochloride

Gabapentin-d6 (hydrochloride) is deuterium labeled Gabapentin (hydrochloride).

  • CAS Number: 1432061-73-8
  • MF: C9H12D6ClNO2
  • MW: 213.73
  • Catalog: Calcium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

CMPDA

CMPDA is a positive allosteric modulator of AMPA receptors with EC50s of 45.4 ± 4.2 nM/63.4 ± 5.6 nM for GluA2i/GluA2o receptor.IC50 value: 45.4 ± 4.2 nM/63.4 ± 5.6 nM(GluA2i/GluA2o) [1]Target: AMPAR modulatorCMPDA was nearly equipotent at modulating the two isoforms of GluA2 receptors, whereas CMPDB displayed a modest preference for the flip splice variant. Similar to CX614, CMPDA slowed the rate of deactivation of GluA2o receptors approximately 2-fold but had no effect on GluA2i receptor deactivation [1].

  • CAS Number: 380607-77-2
  • MF: C16H28N2O4S2
  • MW: 376.53500
  • Catalog: iGluR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-(piperidin-2-ylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamide hydrochloride

Flecainide hydrochloride is a potent and orally active antiarrhythmic agent. Flecainide hydrochloride blocks the cardiac fast inward Na+ current (INa) and the rapid component of the delayed rectifier K+ current. Flecainide hydrochloride prolongs the action potential duration (APD) in ventricular and atrial muscle fibres. Flecainide hydrochloride has the potential for the research of fetal tachycardias[1][2][3].

  • CAS Number: 57415-44-8
  • MF: C17H21ClF6N2O3
  • MW: 450.80400
  • Catalog: Potassium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Etifoxine

Etifoxine(HOE 36-801) is potentiator of GABAA receptor function in cultured neurons. Etifoxine preferentially acts on β2 or β3 subunit-containing GABAA receptors. IC50 value:Target: GABAA receptorEtifoxine exhibits anxiolytic activity in rodents and humans with no sedative, myorelaxant or mnesic side effects. Etifoxine acts as a ligand of the translocator protein (TSPO); promotes axonal regeneration.

  • CAS Number: 21715-46-8
  • MF: C17H17ClN2O
  • MW: 300.783
  • Catalog: GABA Receptor
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 421.2±55.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 208.5±31.5 °C

Norvasc

Amlodipine mesylate, an antianginal agent and an orally active dihydropyridine calcium channel blocker, works by blocking the voltage-dependent L-type calcium channels, thereby inhibiting the initial influx of calcium. Amlodipine mesylate can be used for the research of high blood pressure and cancer[1][2][3].

  • CAS Number: 246852-12-0
  • MF: C21H29ClN2O8S
  • MW: 504.982
  • Catalog: Calcium Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A