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Transporters
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Nimesulide, Inhibitor of B⁰AT1;Inhibitor of COX-1;Inhibitor of COX-2Cas Number: 51803-78-2Formula: C13H12N2O5S Molecular Weight: 308.31IUPAC Name: N-(4-nitro-2-phenoxyphenyl)methanesulfonamideSMILES: CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2InChIKey: HYWYRSMBCFDLJT-UHFFFAOYSA-NInChI: InChI=1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3Synonyms: HMS502C15 | N-(4-Nitro-2-phenoxyphenyl)methanesulfonamide | N-(4-nitro-2-phenoxy-phenyl)methanesulfonamide | NIMESULI...
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Reboxetine, Inhibitor of NETCas Number: 71620-89-8 Compound CID: 127151Formula: C19H23NO3 Molecular Weight: 313.39IUPAC Name: (2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholineSMILES: CCOC1=CC=CC=C1OC(C2CNCCO2)C3=CC=CC=C3InChIKey: CBQGYUDMJHNJBX-RTBURBONSA-NInChI: InChI=1S/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3/t18-,19-/m1/s1Synonyms: Reboxetine|71620-89-8|98769-81-4|Reboxetine [INN]|105017-38-7|(2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholine|9...
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SYM 2081, Inhibitor of Excitatory amino acid transporter 2;Agonist of GluK1;Agonist of GluK2;Agonist of GluK3;Agonist of GluK4;Agonist of GluK5Cas Number: 31137-74-3 Compound CID: 95883Formula: C6H11NO4 Molecular Weight: 161.16IUPAC Name: (2S,4R)-2-amino-4-methylpentanedioic acidSMILES: CC(CC(C(=O)O)N)C(=O)OInChIKey: KRKRAOXTGDJWNI-DMTCNVIQSA-NInChI: InChI=1S/C6H11NO4/c1-3(5(8)9)2-4(7)6(10)11/h3-4H,2,7H2,1H3,(H,8,9)(H,10,11)/t3-,4+/m1/s1Synonyms: XH88WJG9LJ | 4-Methyl-DL-glutamic acid, erythro- | L-Glutamic acid, 4-methyl-, (4R)- | HY-101310 | threo-gamma-Methyl...
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Poly-L-aspartic acid sodium salt, Excitatory amino acid transporter 1;Excitatory amino acid transporter 2;Excitatory amino acid transporter 3;Excitatory amino acid transporter 4;Excitatory amino acid transporter 5Cas Number: 25608-40-6Formula: (C4H5NO3)nIUPAC Name: (2S)-2-aminobutanedioic acidSMILES: C(C(C(=O)O)N)C(=O)OInChIKey: CKLJMWTZIZZHCS-REOHCLBHSA-NInChI: InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1Synonyms: L-aspartic acid|aspartic acid|56-84-8|H-Asp-OH|Asparagic acid|(2S)-2-aminobutanedioic acid|L-aspartate|aspartate|Aspa...
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Dapoxetine, Serotonin transporter inhibitorCas Number: 119356-77-3Formula: C21H23NO Molecular Weight: 305.40IUPAC Name: (1S)-N,N-dimethyl-3-naphthalen-1-yloxy-1-phenylpropan-1-amineSMILES: CN(C)C(CCOC1=CC=CC2=CC=CC=C21)C3=CC=CC=C3InChIKey: USRHYDPUVLEVMC-FQEVSTJZSA-NInChI: InChI=1S/C21H23NO/c1-22(2)20(18-10-4-3-5-11-18)15-16-23-21-14-8-12-17-9-6-7-13-19(17)21/h3-14,20H,15-16H2,1-2H3/t20-/m0/s1Synonyms: Conadil | Benzenemethanamine, N,N-dimethyl-alpha-[2-(1-naphthalenyloxy)ethyl]-, (alphaS)- | Dapoxetine (Free Base) | ...
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Indocyanine Green (ICG), Inhibitor of OATP1B1Cas Number: 3599-32-4 EC Number: 222-751-5Formula: C43H47N2NaO6S2 Molecular Weight: 774.96IUPAC Name: show more
SMILES: CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C=CC=CC=CC=C4C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+]InChIKey: MOFVSTNWEDAEEK-UHFFFAOYSA-MInChI: show more Synonyms: Z2587758505 | Sodium 4-(2-(7-(1,1-dimethyl-3-(4-sulfonatobutyl)-1H-benzo[e]indol-2(3H)-ylidene)hepta-1,3,5-trien-1-yl... -
Cyclosporin A, Cyclophilin A modulatorCas Number: 59865-13-3 Compound CID: 5284373Formula: C62H111N11O12 Molecular Weight: 1202.61IUPAC Name: show more
SMILES: show more InChIKey: PMATZTZNYRCHOR-CGLBZJNRSA-NInChI: show more Synonyms: Cicloral (antibiotic) | cyclosporine | CYCLOSPORINE [HSDB] | Cyclosporine [USAN:USP] | CYCLOSPORINE [VANDF] | Prestwi...
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Ezetimibe, Niemann-Pick C1-like protein 1 inhibitorCas Number: 163222-33-1 EC Number: 682-606-0Formula: C24H21F2NO3 Molecular Weight: 409.43IUPAC Name: (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-oneSMILES: C1=CC(=CC=C1C2C(C(=O)N2C3=CC=C(C=C3)F)CCC(C4=CC=C(C=C4)F)O)OInChIKey: OLNTVTPDXPETLC-XPWALMASSA-NInChI: show more Synonyms: Zetia | Ezetrol | F0112 | NC00134 | Q18472686 | MLS000759443 | (3R,4S)-1-(4-fluorophenyl)-3-((S)-3-(4-fluorophenyl)-3...
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GBR 12909 dihydrochloride, Inhibitor of DAT;σ2;sigma non-opioid intracellular receptor 1Cas Number: 67469-78-7 Compound CID: 104920Formula: C28H32F2N2O.2HCl Molecular Weight: 523.49IUPAC Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochlorideSMILES: C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.ClInChIKey: MIBSKSYCRFWIRU-UHFFFAOYSA-NInChI: show more Synonyms: cis-octadecafluorodecahydronaphthalene | G0541 | Vanoxeamine | 1-(2-[bis(4-Fluorophenyl)methoxy]ethyl)-4-(3-phenylpro...
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Sulfasalazine, Inhibitor of Proton-coupled folate transporterFormula: C18H14N4O5S Molecular Weight: 398.39IUPAC Name: 2-hydroxy-5-[[4-(pyridin-2-ylsulfamoyl)phenyl]diazenyl]benzoic acidSMILES: C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)O)C(=O)OInChIKey: NCEXYHBECQHGNR-UHFFFAOYSA-NInChI: InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,23H,(H,19,22)(H,24,25)Synonyms: 5-(4-(2-Pyridylsulfamoyl)phenylazo)-2-hydroxybenzoic acid | Sulphasalazine | BSPBio_002888 | NSC203730 | NSC-203730 |...
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Ketoprofen, Cyclooxygenase inhibitorCas Number: 22071-15-4 EC Number: 244-759-8Formula: C16H14O3 Molecular Weight: 254.28IUPAC Name: 2-(3-benzoylphenyl)propanoic acidSMILES: CC(C1=CC(=CC=C1)C(=O)C2=CC=CC=C2)C(=O)OInChIKey: DKYWVDODHFEZIM-UHFFFAOYSA-NInChI: InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)Synonyms: DTXSID6020771 | Iso-K | Ketoprofenum [INN-Latin] | Acide (benzoyl-3-phenyl)-2-propionique | KetoMed | KETOPROFEN [JAN...
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α-Cyanocinnamic Acid, Inhibitor of mitochondrial pyruvate carrier 1;Inhibitor of mitochondrial pyruvate carrier 2Cas Number: 1011-92-3 EC Number: 213-788-8Formula: C10H7NO2 Molecular Weight: 173.17IUPAC Name: (E)-2-cyano-3-phenylprop-2-enoic acidSMILES: C1=CC=C(C=C1)C=C(C#N)C(=O)OInChIKey: CDUQMGQIHYISOP-RMKNXTFCSA-NInChI: InChI=1S/C10H7NO2/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-6H,(H,12,13)/b9-6+Synonyms: .alpha.-Cyano-.beta.-phenylacrylic acid | (E)-2-Cyano-3-phenylacrylicacid | Benzylidene ethylcyanoacetane | 2-Propeno...
