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Compile Data Set for Download or QSAR

Found 45 hits Enz. Inhib. hit(s) with all data for entry = 50015196   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152851
PNG
(4-(9H-CARBAZOL-9-YL)BUTANOIC ACID | 4-Carbazol-9-y...)
Show SMILES OC(=O)CCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C16H15NO2/c18-16(19)10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2,(H,18,19)
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n/an/a 570n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152858
PNG
(5-Carbazol-9-yl-pentanoic acid | CHEMBL184795)
Show SMILES OC(=O)CCCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H17NO2/c19-17(20)11-5-6-12-18-15-9-3-1-7-13(15)14-8-2-4-10-16(14)18/h1-4,7-10H,5-6,11-12H2,(H,19,20)
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n/an/a 800n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152850
PNG
(1-HEXYLDECANOIC ACID | CHEMBL82293 | Hexadecanoic ...)
Show SMILES CCCCCCCCCCCCCCCC(O)=O
Show InChI InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)
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n/an/a 930n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152857
PNG
(3-(Carbazole-9-sulfonyl)-thiophene-2-carboxylic ac...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H11NO4S2/c19-17(20)16-15(9-10-23-16)24(21,22)18-13-7-3-1-5-11(13)12-6-2-4-8-14(12)18/h1-10H,(H,19,20)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152850
PNG
(1-HEXYLDECANOIC ACID | CHEMBL82293 | Hexadecanoic ...)
Show SMILES CCCCCCCCCCCCCCCC(O)=O
Show InChI InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152872
PNG
(3-(6-Methyl-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES Cc1ccc2ccn(c2c1)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO4S2/c1-9-2-3-10-4-6-15(11(10)8-9)21(18,19)12-5-7-20-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152852
PNG
(3-(5-Bromo-indole-1-sulfonyl)-thiophene-2-carboxyl...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(Br)ccc12
Show InChI InChI=1S/C13H8BrNO4S2/c14-9-1-2-10-8(7-9)3-5-15(10)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152871
PNG
(3-(3-Methyl-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES Cc1cn(c2ccccc12)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO4S2/c1-9-8-15(11-5-3-2-4-10(9)11)21(18,19)12-6-7-20-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, intestinal


(Homo sapiens (Human))
BDBM50152850
PNG
(1-HEXYLDECANOIC ACID | CHEMBL82293 | Hexadecanoic ...)
Show SMILES CCCCCCCCCCCCCCCC(O)=O
Show InChI InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against intestinal fatty acid binding protein(I-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152866
PNG
(3-(7-Methoxy-indole-1-sulfonyl)-thiophene-2-carbox...)
Show SMILES COc1cccc2ccn(c12)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO5S2/c1-20-10-4-2-3-9-5-7-15(12(9)10)22(18,19)11-6-8-21-13(11)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152865
PNG
(3-(6-Methoxy-indole-1-sulfonyl)-thiophene-2-carbox...)
Show SMILES COc1ccc2ccn(c2c1)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO5S2/c1-20-10-3-2-9-4-6-15(11(9)8-10)22(18,19)12-5-7-21-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, heart


(Homo sapiens (Human))
BDBM50152850
PNG
(1-HEXYLDECANOIC ACID | CHEMBL82293 | Hexadecanoic ...)
Show SMILES CCCCCCCCCCCCCCCC(O)=O
Show InChI InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against heart and muscle fatty acid binding protein(H-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152858
PNG
(5-Carbazol-9-yl-pentanoic acid | CHEMBL184795)
Show SMILES OC(=O)CCCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H17NO2/c19-17(20)11-5-6-12-18-15-9-3-1-7-13(15)14-8-2-4-10-16(14)18/h1-4,7-10H,5-6,11-12H2,(H,19,20)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152863
PNG
(3-(5-Fluoro-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(F)ccc12
Show InChI InChI=1S/C13H8FNO4S2/c14-9-1-2-10-8(7-9)3-5-15(10)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, intestinal


(Homo sapiens (Human))
BDBM50152852
PNG
(3-(5-Bromo-indole-1-sulfonyl)-thiophene-2-carboxyl...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(Br)ccc12
Show InChI InChI=1S/C13H8BrNO4S2/c14-9-1-2-10-8(7-9)3-5-15(10)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 3.90E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against intestinal fatty acid binding protein(I-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152853
PNG
(2-(Carbazole-9-sulfonyl)-benzoic acid | CHEMBL3641...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C19H13NO4S/c21-19(22)15-9-3-6-12-18(15)25(23,24)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-12H,(H,21,22)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152860
PNG
(3-(7-Fluoro-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cccc(F)c12
Show InChI InChI=1S/C13H8FNO4S2/c14-9-3-1-2-8-4-6-15(11(8)9)21(18,19)10-5-7-20-12(10)13(16)17/h1-7H,(H,16,17)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152859
PNG
(3-(6-Fluoro-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2ccc(F)cc12
Show InChI InChI=1S/C13H8FNO4S2/c14-9-2-1-8-3-5-15(10(8)7-9)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, heart


(Homo sapiens (Human))
BDBM50152856
PNG
(3-Carbazol-9-yl-propionic acid | CHEMBL184817)
Show SMILES OC(=O)CCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C15H13NO2/c17-15(18)9-10-16-13-7-3-1-5-11(13)12-6-2-4-8-14(12)16/h1-8H,9-10H2,(H,17,18)
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n/an/a 5.70E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against heart and muscle fatty acid binding protein(H-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152862
PNG
(2-(6-Methoxy-indole-1-sulfonyl)-benzoic acid | CHE...)
Show SMILES COc1ccc2ccn(c2c1)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H13NO5S/c1-22-12-7-6-11-8-9-17(14(11)10-12)23(20,21)15-5-3-2-4-13(15)16(18)19/h2-10H,1H3,(H,18,19)
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n/an/a 6.10E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152851
PNG
(4-(9H-CARBAZOL-9-YL)BUTANOIC ACID | 4-Carbazol-9-y...)
Show SMILES OC(=O)CCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C16H15NO2/c18-16(19)10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2,(H,18,19)
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n/an/a 6.70E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152864
PNG
(3-(5-Methyl-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES Cc1ccc2n(ccc2c1)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO4S2/c1-9-2-3-11-10(8-9)4-6-15(11)21(18,19)12-5-7-20-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 7.10E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152876
PNG
(3-(4-Methyl-indole-1-sulfonyl)-thiophene-2-carboxy...)
Show SMILES Cc1cccc2n(ccc12)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO4S2/c1-9-3-2-4-11-10(9)5-7-15(11)21(18,19)12-6-8-20-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 7.40E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152861
PNG
(2-(3-Methyl-indole-1-sulfonyl)-benzoic acid | CHEM...)
Show SMILES Cc1cn(c2ccccc12)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H13NO4S/c1-11-10-17(14-8-4-2-6-12(11)14)22(20,21)15-9-5-3-7-13(15)16(18)19/h2-10H,1H3,(H,18,19)
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n/an/a 8.50E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152857
PNG
(3-(Carbazole-9-sulfonyl)-thiophene-2-carboxylic ac...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H11NO4S2/c19-17(20)16-15(9-10-23-16)24(21,22)18-13-7-3-1-5-11(13)12-6-2-4-8-14(12)18/h1-10H,(H,19,20)
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n/an/a 9.10E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152856
PNG
(3-Carbazol-9-yl-propionic acid | CHEMBL184817)
Show SMILES OC(=O)CCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C15H13NO2/c17-15(18)9-10-16-13-7-3-1-5-11(13)12-6-2-4-8-14(12)16/h1-8H,9-10H2,(H,17,18)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, heart


(Homo sapiens (Human))
BDBM50152852
PNG
(3-(5-Bromo-indole-1-sulfonyl)-thiophene-2-carboxyl...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(Br)ccc12
Show InChI InChI=1S/C13H8BrNO4S2/c14-9-1-2-10-8(7-9)3-5-15(10)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 9.80E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against heart and muscle fatty acid binding protein(H-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, heart


(Homo sapiens (Human))
BDBM50152857
PNG
(3-(Carbazole-9-sulfonyl)-thiophene-2-carboxylic ac...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H11NO4S2/c19-17(20)16-15(9-10-23-16)24(21,22)18-13-7-3-1-5-11(13)12-6-2-4-8-14(12)18/h1-10H,(H,19,20)
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n/an/a 9.90E+3n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against heart and muscle fatty acid binding protein(H-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152854
PNG
(3-(5-Methoxy-indole-1-sulfonyl)-thiophene-2-carbox...)
Show SMILES COc1ccc2n(ccc2c1)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO5S2/c1-20-10-2-3-11-9(8-10)4-6-15(11)22(18,19)12-5-7-21-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152867
PNG
(2-(4-Fluoro-indole-1-sulfonyl)-benzoic acid | CHEM...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1ccc2c(F)cccc12
Show InChI InChI=1S/C15H10FNO4S/c16-12-5-3-6-13-10(12)8-9-17(13)22(20,21)14-7-2-1-4-11(14)15(18)19/h1-9H,(H,18,19)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152870
PNG
(2-(5-Bromo-indole-1-sulfonyl)-benzoic acid | CHEMB...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1ccc2cc(Br)ccc12
Show InChI InChI=1S/C15H10BrNO4S/c16-11-5-6-13-10(9-11)7-8-17(13)22(20,21)14-4-2-1-3-12(14)15(18)19/h1-9H,(H,18,19)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152875
PNG
(2-(4-Methyl-indole-1-sulfonyl)-benzoic acid | CHEM...)
Show SMILES Cc1cccc2n(ccc12)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H13NO4S/c1-11-5-4-7-14-12(11)9-10-17(14)22(20,21)15-8-3-2-6-13(15)16(18)19/h2-10H,1H3,(H,18,19)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152874
PNG
(3-(4-Methoxy-indole-1-sulfonyl)-thiophene-2-carbox...)
Show SMILES COc1cccc2n(ccc12)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H11NO5S2/c1-20-11-4-2-3-10-9(11)5-7-15(10)22(18,19)12-6-8-21-13(12)14(16)17/h2-8H,1H3,(H,16,17)
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n/an/a 1.30E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152852
PNG
(3-(5-Bromo-indole-1-sulfonyl)-thiophene-2-carboxyl...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1ccc2cc(Br)ccc12
Show InChI InChI=1S/C13H8BrNO4S2/c14-9-1-2-10-8(7-9)3-5-15(10)21(18,19)11-4-6-20-12(11)13(16)17/h1-7H,(H,16,17)
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n/an/a 1.40E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152853
PNG
(2-(Carbazole-9-sulfonyl)-benzoic acid | CHEMBL3641...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C19H13NO4S/c21-19(22)15-9-3-6-12-18(15)25(23,24)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-12H,(H,21,22)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein 5


(Homo sapiens (Human))
BDBM50152856
PNG
(3-Carbazol-9-yl-propionic acid | CHEMBL184817)
Show SMILES OC(=O)CCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C15H13NO2/c17-15(18)9-10-16-13-7-3-1-5-11(13)12-6-2-4-8-14(12)16/h1-8H,9-10H2,(H,17,18)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against epithelial fatty acid binding protein(E-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152877
PNG
(2-(5-Methyl-indole-1-sulfonyl)-benzoic acid | CHEM...)
Show SMILES Cc1ccc2n(ccc2c1)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H13NO4S/c1-11-6-7-14-12(10-11)8-9-17(14)22(20,21)15-5-3-2-4-13(15)16(18)19/h2-10H,1H3,(H,18,19)
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n/an/a 3.00E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152873
PNG
(3-(3-Carbamoyl-indole-1-sulfonyl)-thiophene-2-carb...)
Show SMILES NC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccsc1C(O)=O
Show InChI InChI=1S/C14H10N2O5S2/c15-13(17)9-7-16(10-4-2-1-3-8(9)10)23(20,21)11-5-6-22-12(11)14(18)19/h1-7H,(H2,15,17)(H,18,19)
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n/an/a 3.20E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, heart


(Homo sapiens (Human))
BDBM50152853
PNG
(2-(Carbazole-9-sulfonyl)-benzoic acid | CHEMBL3641...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C19H13NO4S/c21-19(22)15-9-3-6-12-18(15)25(23,24)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-12H,(H,21,22)
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n/an/a 4.20E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against heart and muscle fatty acid binding protein(H-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, intestinal


(Homo sapiens (Human))
BDBM50152857
PNG
(3-(Carbazole-9-sulfonyl)-thiophene-2-carboxylic ac...)
Show SMILES OC(=O)c1sccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C17H11NO4S2/c19-17(20)16-15(9-10-23-16)24(21,22)18-13-7-3-1-5-11(13)12-6-2-4-8-14(12)18/h1-10H,(H,19,20)
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n/an/a 4.20E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against intestinal fatty acid binding protein(I-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152855
PNG
(2-(4-Methoxy-indole-1-sulfonyl)-benzoic acid | CHE...)
Show SMILES COc1cccc2n(ccc12)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H13NO5S/c1-22-14-7-4-6-13-11(14)9-10-17(13)23(20,21)15-8-3-2-5-12(15)16(18)19/h2-10H,1H3,(H,18,19)
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n/an/a 8.90E+4n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, intestinal


(Homo sapiens (Human))
BDBM50152851
PNG
(4-(9H-CARBAZOL-9-YL)BUTANOIC ACID | 4-Carbazol-9-y...)
Show SMILES OC(=O)CCCn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C16H15NO2/c18-16(19)10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2,(H,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against intestinal fatty acid binding protein(I-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152868
PNG
(2-(3-Carbamoyl-indole-1-sulfonyl)-benzoic acid | C...)
Show SMILES NC(=O)c1cn(c2ccccc12)S(=O)(=O)c1ccccc1C(O)=O
Show InChI InChI=1S/C16H12N2O5S/c17-15(19)12-9-18(13-7-3-1-5-10(12)13)24(22,23)14-8-4-2-6-11(14)16(20)21/h1-9H,(H2,17,19)(H,20,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, adipocyte


(Homo sapiens (Human))
BDBM50152869
PNG
(CHEMBL185432 | Carbazol-9-yl-acetic acid)
Show SMILES OC(=O)Cn1c2ccccc2c2ccccc12
Show InChI InChI=1S/C14H11NO2/c16-14(17)9-15-12-7-3-1-5-10(12)11-6-2-4-8-13(11)15/h1-8H,9H2,(H,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against adipocyte fatty acid binding protein(A-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair
Fatty acid-binding protein, intestinal


(Homo sapiens (Human))
BDBM50152853
PNG
(2-(Carbazole-9-sulfonyl)-benzoic acid | CHEMBL3641...)
Show SMILES OC(=O)c1ccccc1S(=O)(=O)n1c2ccccc2c2ccccc12
Show InChI InChI=1S/C19H13NO4S/c21-19(22)15-9-3-6-12-18(15)25(23,24)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-12H,(H,21,22)
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Article
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n/an/a>1.00E+5n/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against intestinal fatty acid binding protein(I-FABP)


Bioorg Med Chem Lett 14: 4445-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.057
BindingDB Entry DOI: 10.7270/Q2XD1155
More data for this
Ligand-Target Pair