Found 10 hits Enz. Inhib. hit(s) with all data for entry = 50004743 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Solute carrier family 22 member 8
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | Reactome pathway
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| DrugBank
Article
PubMed
| 4.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT3-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 6
(Homo sapiens (Human)) | BDBM50206509
(4-Dipropylsulfamoyl-benzoic acid | 4-Dipropylsulfa...)Show InChI InChI=1S/C13H19NO4S/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16/h5-8H,3-4,9-10H2,1-2H3,(H,15,16) | PDB
Reactome pathway
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CHEMBL
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| DrugBank
PDB
Article
PubMed
| 4.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT1-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Solute carrier family 22 member 8
(Homo sapiens (Human)) | BDBM85245
(CAS_36322-90-4 | NSC_4856 | Piroxicam)Show SMILES CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O |t:12| Show InChI InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,19H,1H3,(H,16,17,20) | Reactome pathway
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| DrugBank
Article
PubMed
| 4.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT3-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 6
(Homo sapiens (Human)) | BDBM50485608
(CHEBI:28837 | Caprylic acid | EDENOR C 8-98-100 | ...)Show InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10) | PDB
Reactome pathway
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| Article
PubMed
| 5.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT1-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 6
(Homo sapiens (Human)) | BDBM50240008
(Aminohippuric Acid | CHEBI:104011 | PAHA | Para-Am...)Show InChI InChI=1S/C9H10N2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5,10H2,(H,11,14)(H,12,13) | PDB
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| PDB
Article
PubMed
| 6.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT1-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Solute carrier family 22 member 8
(Homo sapiens (Human)) | BDBM50485608
(CHEBI:28837 | Caprylic acid | EDENOR C 8-98-100 | ...)Show InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10) | Reactome pathway
KEGG
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GoogleScholar
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PC cid
PC sid
PDB
UniChem
| Article
PubMed
| 8.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT3-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 8
(Homo sapiens (Human)) | BDBM50344961
(CHEMBL510139 | citrinin)Show SMILES C[C@H]1OC=C2C(=O)C(C(O)=O)C(=O)C(C)=C2[C@@H]1C |r,c:14,t:3| Show InChI InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,10H,1-3H3,(H,16,17)/t5-,7-,10?/m1/s1 | Reactome pathway
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CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.54E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT3-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 8
(Homo sapiens (Human)) | BDBM50240008
(Aminohippuric Acid | CHEBI:104011 | PAHA | Para-Am...)Show InChI InChI=1S/C9H10N2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5,10H2,(H,11,14)(H,12,13) | Reactome pathway
KEGG
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MCE
PC cid
PC sid
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UniChem
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| Article
PubMed
| 1.96E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT3-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 6
(Homo sapiens (Human)) | BDBM85245
(CAS_36322-90-4 | NSC_4856 | Piroxicam)Show SMILES CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O |t:12| Show InChI InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,19H,1H3,(H,16,17,20) | PDB
Reactome pathway
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| DrugBank
Article
PubMed
| 1.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT1-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
Solute carrier family 22 member 6
(Homo sapiens (Human)) | BDBM50344961
(CHEMBL510139 | citrinin)Show SMILES C[C@H]1OC=C2C(=O)C(C(O)=O)C(=O)C(C)=C2[C@@H]1C |r,c:14,t:3| Show InChI InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,10H,1-3H3,(H,16,17)/t5-,7-,10?/m1/s1 | PDB
Reactome pathway
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CHEMBL
PC cid
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UniChem
| Article
PubMed
| 3.08E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyorin University
Curated by ChEMBL
| Assay Description
TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT1-expressing S2 cells |
Life Sci 69: 2123-35 (2001)
Article DOI: 10.1016/s0024-3205(01)01296-6
BindingDB Entry DOI: 10.7270/Q2XD14JB |
More data for this
Ligand-Target Pair | |
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