Found 44 hits for monomerid = 50204485,50204516,50233957,50234023,50234016,50234024,50233991,50233955,50233986,50233995,50233958,50233994,50233996,50234014,50233992 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | 9.0 | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of rat FAAH expressed in Escherichia coli at pH 9.0 |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | PDB
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Patents
Similars
| Article PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli by [14C]oleamide breakdown |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | PDB
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antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
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| Article PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | 9.0 | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of FAAH (unknown origin) at pH 9 |
Bioorg Med Chem Lett 18: 5847-50 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.086 BindingDB Entry DOI: 10.7270/Q2GF0TBV |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 10.3 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of rat FAAH expressed in Escherichia coli at pH 7.4 |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
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| 10.4 | n/a | n/a | n/a | n/a | n/a | n/a | 7.5 | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of FAAH (unknown origin) at pH 7.5 |
Bioorg Med Chem Lett 18: 5847-50 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.086 BindingDB Entry DOI: 10.7270/Q2GF0TBV |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 14.5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of rat FAAH expressed in Escherichia coli at pH 8.0 |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
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| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli by [14C]oleamide breakdown |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
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| PDB Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | 9.0 | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of FAAH (unknown origin) at pH 9 |
Bioorg Med Chem Lett 18: 5847-50 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.086 BindingDB Entry DOI: 10.7270/Q2GF0TBV |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of rat FAAH expressed in Escherichia coli |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50233957
 (6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picol...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29) | PDB
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| PDB Article PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | 9.0 | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of FAAH (unknown origin) at pH 9 |
Bioorg Med Chem Lett 18: 5847-50 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.086 BindingDB Entry DOI: 10.7270/Q2GF0TBV |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50233957
 (6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picol...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
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| Article PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of human recombinant FAAH expressed in african green monkey COS7 cells |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
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| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of human FAAH expressed in COS7 cells by [14C]oleamide breakdown |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50234023
 (6-(2-(3-(4'-(thiomorpholinomethyl)biphenyl-4-yl)pr...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccc(CN2CCSCC2)cc1 Show InChI InChI=1S/C29H27N3O4S/c33-26(28-30-18-27(36-28)24-2-1-3-25(31-24)29(34)35)13-8-20-4-9-22(10-5-20)23-11-6-21(7-12-23)19-32-14-16-37-17-15-32/h1-7,9-12,18H,8,13-17,19H2,(H,34,35) | PDB
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| 28 | n/a | n/a | n/a | n/a | n/a | n/a | 9.0 | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of FAAH (unknown origin) at pH 9 |
Bioorg Med Chem Lett 18: 5847-50 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.086 BindingDB Entry DOI: 10.7270/Q2GF0TBV |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50234023
 (6-(2-(3-(4'-(thiomorpholinomethyl)biphenyl-4-yl)pr...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccc(CN2CCSCC2)cc1 Show InChI InChI=1S/C29H27N3O4S/c33-26(28-30-18-27(36-28)24-2-1-3-25(31-24)29(34)35)13-8-20-4-9-22(10-5-20)23-11-6-21(7-12-23)19-32-14-16-37-17-15-32/h1-7,9-12,18H,8,13-17,19H2,(H,34,35) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 28 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
ITGA5/ITGB1
(Homo sapiens (Human)) | BDBM50233955
 (CHEMBL4095441)Show SMILES CCN(CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C)CCOCCOCCOCc1cn(CCCCN2C[C@@H]3C[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N3)nn1 Show InChI InChI=1S/C50H72FN15O11/c1-4-64(15-12-54-49(74)44-30(2)39(57-31(44)3)24-36-35-22-32(51)9-10-37(35)60-45(36)70)16-17-75-18-19-76-20-21-77-29-34-28-66(63-62-34)14-6-5-13-65-27-33-23-41(65)48(73)61-38(8-7-11-55-50(52)53)46(71)56-26-42(67)59-40(25-43(68)69)47(72)58-33/h9-10,22,24,28,33,38,40-41,57H,4-8,11-21,23,25-27,29H2,1-3H3,(H,54,74)(H,56,71)(H,58,72)(H,59,67)(H,60,70)(H,61,73)(H,68,69)(H4,52,53,55)/b36-24-/t33-,38-,40-,41-/m0/s1 | PDB
Reactome pathway
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| Article PubMed
| n/a | n/a | 101 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Displacement of biotinylated fibronectin from recombinant human integrin alpha5beta1 dark incubated for 3 hrs by solid-phase receptor binding assay |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
ITGAV/ITGB3
(Homo sapiens (Human)) | BDBM50233955
 (CHEMBL4095441)Show SMILES CCN(CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C)CCOCCOCCOCc1cn(CCCCN2C[C@@H]3C[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N3)nn1 Show InChI InChI=1S/C50H72FN15O11/c1-4-64(15-12-54-49(74)44-30(2)39(57-31(44)3)24-36-35-22-32(51)9-10-37(35)60-45(36)70)16-17-75-18-19-76-20-21-77-29-34-28-66(63-62-34)14-6-5-13-65-27-33-23-41(65)48(73)61-38(8-7-11-55-50(52)53)46(71)56-26-42(67)59-40(25-43(68)69)47(72)58-33/h9-10,22,24,28,33,38,40-41,57H,4-8,11-21,23,25-27,29H2,1-3H3,(H,54,74)(H,56,71)(H,58,72)(H,59,67)(H,60,70)(H,61,73)(H,68,69)(H4,52,53,55)/b36-24-/t33-,38-,40-,41-/m0/s1 | PDB
Reactome pathway
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antibodypedia antibodypedia GoogleScholar
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Similars
| Article PubMed
| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Displacement of biotinylated vitronectin from recombinant human integrin alphaVbeta3 dark incubated for 3 hrs by solid-phase receptor binding assay |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
ITGA5/ITGB1
(Homo sapiens (Human)) | BDBM50233958
 (CHEMBL4087743)Show SMILES NCCN1C[C@@H]2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N2 Show InChI InChI=1S/C19H33N9O6/c20-3-5-28-9-10-6-13(28)18(34)27-11(2-1-4-23-19(21)22)16(32)24-8-14(29)26-12(7-15(30)31)17(33)25-10/h10-13H,1-9,20H2,(H,24,32)(H,25,33)(H,26,29)(H,27,34)(H,30,31)(H4,21,22,23)/t10-,11-,12-,13-/m0/s1 | PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia antibodypedia GoogleScholar
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Similars
| Article PubMed
| n/a | n/a | 152 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Inhibition of alpha5beta1 (unknown origin) |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
ITGAV/ITGB5
(Homo sapiens (Human)) | BDBM50233958
 (CHEMBL4087743)Show SMILES NCCN1C[C@@H]2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N2 Show InChI InChI=1S/C19H33N9O6/c20-3-5-28-9-10-6-13(28)18(34)27-11(2-1-4-23-19(21)22)16(32)24-8-14(29)26-12(7-15(30)31)17(33)25-10/h10-13H,1-9,20H2,(H,24,32)(H,25,33)(H,26,29)(H,27,34)(H,30,31)(H4,21,22,23)/t10-,11-,12-,13-/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 315 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Displacement of biotinylated vitronectin from human integrin alphaVbeta5 measured after 3 hrs by solid-phase receptor binding assay |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
ITGAV/ITGB3
(Homo sapiens (Human)) | BDBM50233958
 (CHEMBL4087743)Show SMILES NCCN1C[C@@H]2C[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N2 Show InChI InChI=1S/C19H33N9O6/c20-3-5-28-9-10-6-13(28)18(34)27-11(2-1-4-23-19(21)22)16(32)24-8-14(29)26-12(7-15(30)31)17(33)25-10/h10-13H,1-9,20H2,(H,24,32)(H,25,33)(H,26,29)(H,27,34)(H,30,31)(H4,21,22,23)/t10-,11-,12-,13-/m0/s1 | PDB
Reactome pathway
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Displacement of biotinylated vitronectin from human integrin alphaVbeta3 measured after 3 hrs by solid-phase receptor binding assay |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
Dynamin-2
(Homo sapiens (Human)) | BDBM50233996
 (CHEMBL4073407)Show InChI InChI=1S/C18H35N5/c1-4-5-6-7-8-9-10-11-13-19-17-12-14-20-18(22-17)21-15-16-23(2)3/h12,14H,4-11,13,15-16H2,1-3H3,(H2,19,20,21,22) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Newcastle
Curated by ChEMBL
| Assay Description Inhibition of dynamin 2 in human U2OS cells assessed as reduction in clathrin-mediated endocytosis by measuring transferrin-A594 uptake preincubated ... |
J Med Chem 60: 349-361 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01422 BindingDB Entry DOI: 10.7270/Q27M0B6T |
More data for this Ligand-Target Pair | |
ATP-citrate synthase
(Homo sapiens (Human)) | BDBM50234014
 (CHEMBL4072039)Show SMILES Cc1cc(O)c2C(=O)c3c(O)c4CN(COc4cc3C(=O)c2c1)c1ccc2ocnc2c1 Show InChI InChI=1S/C24H16N2O6/c1-11-4-13-20(17(27)5-11)24(30)21-14(22(13)28)7-19-15(23(21)29)8-26(10-32-19)12-2-3-18-16(6-12)25-9-31-18/h2-7,9,27,29H,8,10H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.97E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School
Curated by ChEMBL
| Assay Description Inhibition of ATP citrate lyase (unknown origin) using sodium citrate as substrate after 60 mins by ADP-Glo luminescence assay |
Eur J Med Chem 126: 920-928 (2017)
Article DOI: 10.1016/j.ejmech.2016.12.018 BindingDB Entry DOI: 10.7270/Q2028TSK |
More data for this Ligand-Target Pair | |
ATP-citrate synthase
(Homo sapiens (Human)) | BDBM50234016
 (CHEMBL4093300)Show InChI InChI=1S/C15H9ClO5/c1-5-2-6-10(8(17)3-5)14(20)11-7(13(6)19)4-9(18)12(16)15(11)21/h2-4,17-18,21H,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia GoogleScholar
| CHEMBL KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Harvard Medical School
Curated by ChEMBL
| Assay Description Inhibition of ATP citrate lyase (unknown origin) using sodium citrate as substrate after 60 mins by ADP-Glo luminescence assay |
Eur J Med Chem 126: 920-928 (2017)
Article DOI: 10.1016/j.ejmech.2016.12.018 BindingDB Entry DOI: 10.7270/Q2028TSK |
More data for this Ligand-Target Pair | |
Microtubule-associated protein 2
(Homo sapiens (Human)) | BDBM50234024
 (CHEMBL4097198)Show InChI InChI=1S/C17H19N5O/c1-12-5-2-3-7-14(12)23-9-13-6-4-8-22(13)17-15-16(19-10-18-15)20-11-21-17/h2-3,5,7,10-11,13H,4,6,8-9H2,1H3,(H,18,19,20,21)/t13-/m1/s1 | KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck KGaA
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His tagged MetAP-2 using tripeptide Met-Ala-Ser as substrate preincubated for 15 mins followed by substrat... |
Bioorg Med Chem Lett 27: 551-556 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.019 BindingDB Entry DOI: 10.7270/Q2V98BB4 |
More data for this Ligand-Target Pair | |
Tryptophan 5-hydroxylase 1
(Homo sapiens (Human)) | BDBM50233986
 (CHEMBL4092679)Show SMILES Nc1nc(O[C@H](c2ccc(cc2)-c2ccc3[nH]ncc3c2)C(F)(F)F)cc(n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1 Show InChI InChI=1S/C28H28F3N7O3/c29-28(30,31)24(17-3-1-16(2-4-17)18-5-6-20-19(11-18)14-34-37-20)41-23-12-22(35-26(32)36-23)38-9-7-27(8-10-38)13-21(25(39)40)33-15-27/h1-6,11-12,14,21,24,33H,7-10,13,15H2,(H,34,37)(H,39,40)(H2,32,35,36)/t21-,24+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Karos Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of TPH1 (unknown origin) |
Bioorg Med Chem Lett 27: 413-419 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.053 BindingDB Entry DOI: 10.7270/Q21V5H7S |
More data for this Ligand-Target Pair | |
Tryptophan 5-hydroxylase 1
(Homo sapiens (Human)) | BDBM50233991
 (CHEMBL4060643)Show SMILES Nc1nc(O[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc(n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1 Show InChI InChI=1S/C21H23ClF3N5O3/c22-13-3-1-12(2-4-13)17(21(23,24)25)33-16-9-15(28-19(26)29-16)30-7-5-20(6-8-30)10-14(18(31)32)27-11-20/h1-4,9,14,17,27H,5-8,10-11H2,(H,31,32)(H2,26,28,29)/t14-,17+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Karos Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of TPH1 (unknown origin) |
Bioorg Med Chem Lett 27: 413-419 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.053 BindingDB Entry DOI: 10.7270/Q21V5H7S |
More data for this Ligand-Target Pair | |
Tryptophan 5-hydroxylase 1
(Homo sapiens (Human)) | BDBM50233992
 (CHEMBL4074718)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cc(Cl)ccc1[C@@H](Oc1cc(nc(N)n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1)C(F)(F)F Show InChI InChI=1S/C28H29ClF3N5O5S/c1-43(40,41)18-5-2-16(3-6-18)20-12-17(29)4-7-19(20)24(28(30,31)32)42-23-13-22(35-26(33)36-23)37-10-8-27(9-11-37)14-21(25(38)39)34-15-27/h2-7,12-13,21,24,34H,8-11,14-15H2,1H3,(H,38,39)(H2,33,35,36)/t21-,24+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 885 | n/a | n/a | n/a | n/a | n/a | n/a |
Karos Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of TPH1 (unknown origin) |
Bioorg Med Chem Lett 27: 413-419 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.053 BindingDB Entry DOI: 10.7270/Q21V5H7S |
More data for this Ligand-Target Pair | |
Tryptophan 5-hydroxylase 1
(Homo sapiens (Human)) | BDBM50233994
 (CHEMBL4076761)Show SMILES Cc1cccc(n1)-c1cc(Cl)ccc1[C@@H](Oc1cc(nc(N)n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1)C(F)(F)F Show InChI InChI=1S/C27H28ClF3N6O3/c1-15-3-2-4-19(34-15)18-11-16(28)5-6-17(18)23(27(29,30)31)40-22-12-21(35-25(32)36-22)37-9-7-26(8-10-37)13-20(24(38)39)33-14-26/h2-6,11-12,20,23,33H,7-10,13-14H2,1H3,(H,38,39)(H2,32,35,36)/t20-,23+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Karos Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of TPH1 (unknown origin) |
Bioorg Med Chem Lett 27: 413-419 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.053 BindingDB Entry DOI: 10.7270/Q21V5H7S |
More data for this Ligand-Target Pair | |
ITGAV/ITGB3
(Homo sapiens (Human)) | BDBM50233955
 (CHEMBL4095441)Show SMILES CCN(CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C)CCOCCOCCOCc1cn(CCCCN2C[C@@H]3C[C@H]2C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N3)nn1 Show InChI InChI=1S/C50H72FN15O11/c1-4-64(15-12-54-49(74)44-30(2)39(57-31(44)3)24-36-35-22-32(51)9-10-37(35)60-45(36)70)16-17-75-18-19-76-20-21-77-29-34-28-66(63-62-34)14-6-5-13-65-27-33-23-41(65)48(73)61-38(8-7-11-55-50(52)53)46(71)56-26-42(67)59-40(25-43(68)69)47(72)58-33/h9-10,22,24,28,33,38,40-41,57H,4-8,11-21,23,25-27,29H2,1-3H3,(H,54,74)(H,56,71)(H,58,72)(H,59,67)(H,60,70)(H,61,73)(H,68,69)(H4,52,53,55)/b36-24-/t33-,38-,40-,41-/m0/s1 | PDB
Reactome pathway
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Parma
Curated by ChEMBL
| Assay Description Inhibition of vitronectin binding to alphaVbeta3 in human EPC in presence of MnCl2 measured after 30 mins by crystal violet staining based cell adhes... |
J Med Chem 60: 248-262 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01266 BindingDB Entry DOI: 10.7270/Q2CC12ZK |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli by [14C]oleamide breakdown |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Acyl-CoA: cholesterol acyltransferase (ACAT)
(Homo sapiens (Human)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of TGH |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Tryptophan 5-hydroxylase 1
(Homo sapiens (Human)) | BDBM50233995
 (CHEMBL4091280)Show SMILES Nc1nc(O[C@H](c2ccc(Cl)cc2-c2cccnc2)C(F)(F)F)cc(n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1 Show InChI InChI=1S/C26H26ClF3N6O3/c27-16-3-4-17(18(10-16)15-2-1-7-32-13-15)22(26(28,29)30)39-21-11-20(34-24(31)35-21)36-8-5-25(6-9-36)12-19(23(37)38)33-14-25/h1-4,7,10-11,13,19,22,33H,5-6,8-9,12,14H2,(H,37,38)(H2,31,34,35)/t19-,22+/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 65 | n/a | n/a | n/a | n/a | n/a | n/a |
Karos Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of TPH1 (unknown origin) |
Bioorg Med Chem Lett 27: 413-419 (2017)
Article DOI: 10.1016/j.bmcl.2016.12.053 BindingDB Entry DOI: 10.7270/Q21V5H7S |
More data for this Ligand-Target Pair | |
Neutral cholesterol ester hydrolase 1
(Homo sapiens (Human)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 2.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of KIAA1363 hydrolase |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Neutral cholesterol ester hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of KIAA1363 hydrolase |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204485
 (CHEMBL219880 | methyl 6-(2-(7-phenylheptanoyl)oxaz...)Show SMILES COC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C23H24N2O4/c1-28-23(27)19-14-9-13-18(25-19)21-16-24-22(29-21)20(26)15-8-3-2-5-10-17-11-6-4-7-12-17/h4,6-7,9,11-14,16H,2-3,5,8,10,15H2,1H3 | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of rat FAAH expressed in Escherichia coli |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |
Acyl-CoA: cholesterol acyltransferase (ACAT)
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of TGH |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair | |
Neutral cholesterol ester hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of KIAA1363 |
J Med Chem 50: 1058-68 (2007)
Article DOI: 10.1021/jm0611509 BindingDB Entry DOI: 10.7270/Q26H4J6G |
More data for this Ligand-Target Pair | |
Acyl-CoA: cholesterol acyltransferase (ACAT)
(Homo sapiens (Human)) | BDBM50233957
 (6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picol...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of TGH |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Neutral cholesterol ester hydrolase 1
(Homo sapiens (Human)) | BDBM50233957
 (6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picol...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of KIAA1363 |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Neutral cholesterol ester hydrolase 1
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of KIAA1363 |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Fatty-acid amide hydrolase 1 (aa 30-579)
(Rattus norvegicus (rat)) | BDBM50233957
 (6-(2-(3-(biphenyl-4-yl)propanoyl)oxazol-5-yl)picol...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C24H18N2O4/c27-21(14-11-16-9-12-18(13-10-16)17-5-2-1-3-6-17)23-25-15-22(30-23)19-7-4-8-20(26-19)24(28)29/h1-10,12-13,15H,11,14H2,(H,28,29) | PDB MMDB
UniProtKB/SwissProt
GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of rat recombinant FAAH expressed in Escherichia coli |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Acyl-CoA: cholesterol acyltransferase (ACAT)
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute
Curated by ChEMBL
| Assay Description Inhibition of TGH |
J Med Chem 51: 937-47 (2008)
Article DOI: 10.1021/jm701210y BindingDB Entry DOI: 10.7270/Q2QV3NCP |
More data for this Ligand-Target Pair | |
Acyl-CoA: cholesterol acyltransferase (ACAT)
(Homo sapiens (Human)) | BDBM50204516
 (6-(2-(7-phenylheptanoyl)oxazol-5-yl)picolinic acid...)Show SMILES OC(=O)c1cccc(n1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1 Show InChI InChI=1S/C22H22N2O4/c25-19(14-7-2-1-4-9-16-10-5-3-6-11-16)21-23-15-20(28-21)17-12-8-13-18(24-17)22(26)27/h3,5-6,8,10-13,15H,1-2,4,7,9,14H2,(H,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank GoogleScholar
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute for Chemical Biology
Curated by ChEMBL
| Assay Description Inhibition of TGH |
J Med Chem 51: 4392-403 (2008)
Article DOI: 10.1021/jm800136b BindingDB Entry DOI: 10.7270/Q26D5TW3 |
More data for this Ligand-Target Pair | |