Compile Data Set for Download or QSAR

Found 96 hits Enz. Inhib. hit(s) with all data for assayid = 12 entry = 50036953   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50102608 (11-Isobutyl-2,10-dioxo-1-oxa-3,9-diaza-cyclopentad...) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C24H41N5O8/c1-16(2)14-18-17(22(32)28-35)6-5-11-37-24(34)25-8-4-3-7-19(27-21(18)31)23(33)26-15-20(30)29-9-12-36-13-10-29/h16-19,35H,3-15H2,1-2H3,(H,25,34)(H,26,33)(H,27,31)(H,28,32)/t17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409270 (CHEMBL90727) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCN(CC1)c1ccccn1)C(=O)NO Show InChI InChI=1S/C29H45N7O7/c1-20(2)18-22-21(27(39)34-42)8-7-17-43-29(41)31-12-5-3-9-23(33-26(22)38)28(40)32-19-25(37)36-15-13-35(14-16-36)24-10-4-6-11-30-24/h4,6,10-11,20-23,42H,3,5,7-9,12-19H2,1-2H3,(H,31,41)(H,32,40)(H,33,38)(H,34,39)/t21-,22+,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409288 (CHEMBL313082) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCN(CC1)c1ccccc1)C(=O)NO Show InChI InChI=1S/C30H46N6O7/c1-21(2)19-24-23(28(39)34-42)11-8-18-43-30(41)31-13-7-6-12-25(33-27(24)38)29(40)32-20-26(37)36-16-14-35(15-17-36)22-9-4-3-5-10-22/h3-5,9-10,21,23-25,42H,6-8,11-20H2,1-2H3,(H,31,41)(H,32,40)(H,33,38)(H,34,39)/t23-,24+,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409290 (CHEMBL88284) Show SMILES COC(=O)c1csc(NC(=O)[C@@H]2CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N2)C(=O)NO)n1 Show InChI InChI=1S/C23H35N5O8S/c1-13(2)11-15-14(19(30)28-34)7-6-10-36-23(33)24-9-5-4-8-16(25-18(15)29)20(31)27-22-26-17(12-37-22)21(32)35-3/h12-16,34H,4-11H2,1-3H3,(H,24,33)(H,25,29)(H,28,30)(H,26,27,31)/t14-,15+,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409236 (CHEMBL330513) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCCc1ccccc1O)C(=O)NO Show InChI InChI=1S/C26H40N4O7/c1-17(2)16-20-19(24(33)30-36)9-7-15-37-26(35)28-13-6-5-10-21(29-23(20)32)25(34)27-14-12-18-8-3-4-11-22(18)31/h3-4,8,11,17,19-21,31,36H,5-7,9-10,12-16H2,1-2H3,(H,27,34)(H,28,35)(H,29,32)(H,30,33)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	85	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409230 (CHEMBL88656) Show SMILES COc1ccc2c(CCNC(=O)[C@@H]3CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N3)C(=O)NO)c[nH]c2c1 Show InChI InChI=1S/C29H43N5O7/c1-18(2)15-23-22(27(36)34-39)7-6-14-41-29(38)31-12-5-4-8-24(33-26(23)35)28(37)30-13-11-19-17-32-25-16-20(40-3)9-10-21(19)25/h9-10,16-18,22-24,32,39H,4-8,11-15H2,1-3H3,(H,30,37)(H,31,38)(H,33,35)(H,34,36)/t22-,23+,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409256 (CHEMBL88445) Show SMILES CNC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C25H45N5O7/c1-15(2)13-18-17(22(32)30-36)9-8-12-37-25(35)27-11-7-6-10-19(28-21(18)31)24(34)29-20(14-16(3)4)23(33)26-5/h15-20,36H,6-14H2,1-5H3,(H,26,33)(H,27,35)(H,28,31)(H,29,34)(H,30,32)/t17-,18+,19-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409281 (CHEMBL419865) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@H](CO)C(=O)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C25H43N5O9/c1-16(2)14-18-17(22(33)29-37)6-5-11-39-25(36)26-8-4-3-7-19(27-21(18)32)23(34)28-20(15-31)24(35)30-9-12-38-13-10-30/h16-20,31,37H,3-15H2,1-2H3,(H,26,36)(H,27,32)(H,28,34)(H,29,33)/t17-,18+,19-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409295 (CHEMBL2115226) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@H]1[C@@H](O)Cc2ccccc12)C(=O)NO Show InChI InChI=1S/C27H40N4O7/c1-16(2)14-20-19(25(34)31-37)10-7-13-38-27(36)28-12-6-5-11-21(29-24(20)33)26(35)30-23-18-9-4-3-8-17(18)15-22(23)32/h3-4,8-9,16,19-23,32,37H,5-7,10-15H2,1-2H3,(H,28,36)(H,29,33)(H,30,35)(H,31,34)/t19-,20+,21-,22-,23+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409223 (CHEMBL90332) Show SMILES CNC(=O)CNC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C21H37N5O7/c1-13(2)11-15-14(19(29)26-32)7-6-10-33-21(31)23-9-5-4-8-16(25-18(15)28)20(30)24-12-17(27)22-3/h13-16,32H,4-12H2,1-3H3,(H,22,27)(H,23,31)(H,24,30)(H,25,28)(H,26,29)/t14-,15+,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409224 (CHEMBL431008) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCN(C)CC1)C(=O)NO Show InChI InChI=1S/C26H46N6O7/c1-18(2)16-20-19(24(35)29-38)8-7-15-39-26(37)31(4)10-6-5-9-21(28-23(20)34)25(36)27-17-22(33)32-13-11-30(3)12-14-32/h18-21,38H,5-17H2,1-4H3,(H,27,36)(H,28,34)(H,29,35)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409282 (CHEMBL330547) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)Nc1nc(CC(=O)N2CCOCC2)cs1)C(=O)NO Show InChI InChI=1S/C27H42N6O8S/c1-17(2)14-20-19(24(36)32-39)6-5-11-41-27(38)28-8-4-3-7-21(30-23(20)35)25(37)31-26-29-18(16-42-26)15-22(34)33-9-12-40-13-10-33/h16-17,19-21,39H,3-15H2,1-2H3,(H,28,38)(H,30,35)(H,32,36)(H,29,31,37)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409286 (CHEMBL89406) Show SMILES CCOC(=O)N1CCC(CC1)NC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C26H45N5O8/c1-4-38-26(36)31-13-10-18(11-14-31)28-24(34)21-9-5-6-12-27-25(35)39-15-7-8-19(23(33)30-37)20(16-17(2)3)22(32)29-21/h17-21,37H,4-16H2,1-3H3,(H,27,35)(H,28,34)(H,29,32)(H,30,33)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409276 (CHEMBL88651) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCCc1c[nH]c2ccc(F)cc12)C(=O)NO Show InChI InChI=1S/C28H40FN5O6/c1-17(2)14-22-20(26(36)34-39)6-5-13-40-28(38)31-11-4-3-7-24(33-25(22)35)27(37)30-12-10-18-16-32-23-9-8-19(29)15-21(18)23/h8-9,15-17,20,22,24,32,39H,3-7,10-14H2,1-2H3,(H,30,37)(H,31,38)(H,33,35)(H,34,36)/t20-,22+,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409226 (CHEMBL312972) Show SMILES CCOC(=O)N1CCN(CC1)C(=O)CNC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C27H46N6O9/c1-4-41-27(39)33-13-11-32(12-14-33)22(34)17-29-25(37)21-9-5-6-10-28-26(38)42-15-7-8-19(24(36)31-40)20(16-18(2)3)23(35)30-21/h18-21,40H,4-17H2,1-3H3,(H,28,38)(H,29,37)(H,30,35)(H,31,36)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409267 (CHEMBL88342) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)N1CCCCC1)cc2)C(=O)NO Show InChI InChI=1S/C27H40N4O6/c1-18(2)15-22-21(26(34)30-36)7-6-14-37-20-10-8-19(9-11-20)16-23(29-25(22)33)27(35)28-17-24(32)31-12-4-3-5-13-31/h8-11,18,21-23,36H,3-7,12-17H2,1-2H3,(H,28,35)(H,29,33)(H,30,34)/t21-,22+,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409296 (CHEMBL88133) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@H](C)C(=O)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C25H43N5O8/c1-16(2)15-19-18(22(32)29-36)7-6-12-38-25(35)26-9-5-4-8-20(28-21(19)31)23(33)27-17(3)24(34)30-10-13-37-14-11-30/h16-20,36H,4-15H2,1-3H3,(H,26,35)(H,27,33)(H,28,31)(H,29,32)/t17-,18+,19-,20+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409278 (CHEMBL316158) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CC(C)OC(C)C1)C(=O)NO Show InChI InChI=1S/C26H45N5O8/c1-16(2)12-20-19(24(34)30-37)8-7-11-38-26(36)27-10-6-5-9-21(29-23(20)33)25(35)28-13-22(32)31-14-17(3)39-18(4)15-31/h16-21,37H,5-15H2,1-4H3,(H,27,36)(H,28,35)(H,29,33)(H,30,34)/t17?,18?,19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409293 (CHEMBL315276) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCN(C)CC1)C(=O)NO Show InChI InChI=1S/C25H44N6O7/c1-17(2)15-19-18(23(34)29-37)7-6-14-38-25(36)26-9-5-4-8-20(28-22(19)33)24(35)27-16-21(32)31-12-10-30(3)11-13-31/h17-20,37H,4-16H2,1-3H3,(H,26,36)(H,27,35)(H,28,33)(H,29,34)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409239 (CHEMBL86542) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCCC(=O)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C25H43N5O8/c1-17(2)16-19-18(23(33)29-36)6-5-13-38-25(35)27-9-4-3-7-20(28-22(19)32)24(34)26-10-8-21(31)30-11-14-37-15-12-30/h17-20,36H,3-16H2,1-2H3,(H,26,34)(H,27,35)(H,28,32)(H,29,33)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409275 (CHEMBL315393) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCC(CC1)N1CCCCC1)C(=O)NO Show InChI InChI=1S/C30H52N6O7/c1-21(2)19-24-23(28(39)34-42)9-8-18-43-30(41)31-13-5-4-10-25(33-27(24)38)29(40)32-20-26(37)36-16-11-22(12-17-36)35-14-6-3-7-15-35/h21-25,42H,3-20H2,1-2H3,(H,31,41)(H,32,40)(H,33,38)(H,34,39)/t23-,24+,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409273 (CHEMBL89419) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)Nc1ccc(cc1)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C28H43N5O7/c1-19(2)18-23-22(26(35)32-38)6-5-15-40-28(37)29-12-4-3-7-24(31-25(23)34)27(36)30-20-8-10-21(11-9-20)33-13-16-39-17-14-33/h8-11,19,22-24,38H,3-7,12-18H2,1-2H3,(H,29,37)(H,30,36)(H,31,34)(H,32,35)/t22-,23+,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409233 (CHEMBL315721) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)N1CCC(O)CC1)cc2)C(=O)NO Show InChI InChI=1S/C27H40N4O7/c1-17(2)14-22-21(26(35)30-37)4-3-13-38-20-7-5-18(6-8-20)15-23(29-25(22)34)27(36)28-16-24(33)31-11-9-19(32)10-12-31/h5-8,17,19,21-23,32,37H,3-4,9-16H2,1-2H3,(H,28,36)(H,29,34)(H,30,35)/t21-,22+,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409255 (CHEMBL330723) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)Nc1ccccn1)C(=O)NO Show InChI InChI=1S/C26H40N6O7/c1-17(2)15-19-18(24(35)31-38)9-8-14-39-26(37)32(3)13-7-5-10-20(29-23(19)34)25(36)28-16-22(33)30-21-11-4-6-12-27-21/h4,6,11-12,17-20,38H,5,7-10,13-16H2,1-3H3,(H,28,36)(H,29,34)(H,31,35)(H,27,30,33)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409261 (CHEMBL88979) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)Nc1ccccc1)cc2)C(=O)NO Show InChI InChI=1S/C28H36N4O6/c1-18(2)15-23-22(27(35)32-37)9-6-14-38-21-12-10-19(11-13-21)16-24(31-26(23)34)28(36)29-17-25(33)30-20-7-4-3-5-8-20/h3-5,7-8,10-13,18,22-24,37H,6,9,14-17H2,1-2H3,(H,29,36)(H,30,33)(H,31,34)(H,32,35)/t22-,23+,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409262 (CHEMBL89335) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)NC(C)(C)C)cc2)C(=O)NO Show InChI InChI=1S/C26H40N4O6/c1-16(2)13-20-19(24(33)30-35)7-6-12-36-18-10-8-17(9-11-18)14-21(28-23(20)32)25(34)27-15-22(31)29-26(3,4)5/h8-11,16,19-21,35H,6-7,12-15H2,1-5H3,(H,27,34)(H,28,32)(H,29,31)(H,30,33)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409264 (CHEMBL89034) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCOCC1)C(=O)NO Show InChI InChI=1S/C25H43N5O8/c1-17(2)15-19-18(23(33)28-36)7-6-12-38-25(35)29(3)9-5-4-8-20(27-22(19)32)24(34)26-16-21(31)30-10-13-37-14-11-30/h17-20,36H,4-16H2,1-3H3,(H,26,34)(H,27,32)(H,28,33)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409284 (CHEMBL315318) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)NC1CCC1)cc2)C(=O)NO Show InChI InChI=1S/C26H38N4O6/c1-16(2)13-21-20(25(33)30-35)7-4-12-36-19-10-8-17(9-11-19)14-22(29-24(21)32)26(34)27-15-23(31)28-18-5-3-6-18/h8-11,16,18,20-22,35H,3-7,12-15H2,1-2H3,(H,27,34)(H,28,31)(H,29,32)(H,30,33)/t20-,21+,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409298 (CHEMBL89426) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)Nc1ccccn1)C(=O)NO Show InChI InChI=1S/C24H37N5O6/c1-16(2)15-18-17(22(31)28-34)9-8-14-35-24(33)29(3)13-7-5-10-19(26-21(18)30)23(32)27-20-11-4-6-12-25-20/h4,6,11-12,16-19,34H,5,7-10,13-15H2,1-3H3,(H,26,30)(H,28,31)(H,25,27,32)/t17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409266 (CHEMBL327639) Show SMILES CNC(=O)[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C30H54N6O9/c1-19(2)18-21-20(25(38)36-43)12-11-17-44-28(41)32-15-9-8-14-23(34-24(21)37)27(40)35-22(26(39)31-6)13-7-10-16-33-29(42)45-30(3,4)5/h19-23,43H,7-18H2,1-6H3,(H,31,39)(H,32,41)(H,33,42)(H,34,37)(H,35,40)(H,36,38)/t20-,21+,22+,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409258 (CHEMBL88906) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCC(CC1)C(O)=O)C(=O)NO Show InChI InChI=1S/C26H43N5O9/c1-16(2)14-19-18(23(34)30-39)6-5-13-40-26(38)27-10-4-3-7-20(29-22(19)33)24(35)28-15-21(32)31-11-8-17(9-12-31)25(36)37/h16-20,39H,3-15H2,1-2H3,(H,27,38)(H,28,35)(H,29,33)(H,30,34)(H,36,37)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50102594 (7-Isobutyl-8-oxo-2-oxa-9-aza-bicyclo[10.2.2]hexade...) Show SMILES CNC(=O)CNC(=O)[C@@H]1Cc2ccc(OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO)cc2 Show InChI InChI=1S/C23H34N4O6/c1-14(2)11-18-17(22(30)27-32)5-4-10-33-16-8-6-15(7-9-16)12-19(26-21(18)29)23(31)25-13-20(28)24-3/h6-9,14,17-19,32H,4-5,10-13H2,1-3H3,(H,24,28)(H,25,31)(H,26,29)(H,27,30)/t17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409279 (CHEMBL92546) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)NCC(F)(F)F)cc2)C(=O)NO Show InChI InChI=1S/C24H33F3N4O6/c1-14(2)10-18-17(22(34)31-36)4-3-9-37-16-7-5-15(6-8-16)11-19(30-21(18)33)23(35)28-12-20(32)29-13-24(25,26)27/h5-8,14,17-19,36H,3-4,9-13H2,1-2H3,(H,28,35)(H,29,32)(H,30,33)(H,31,34)/t17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409285 (CHEMBL89137) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NC[C@@H]1CCCO1)C(=O)NO Show InChI InChI=1S/C23H40N4O7/c1-15(2)13-18-17(21(29)27-32)8-6-12-34-23(31)24-10-4-3-9-19(26-20(18)28)22(30)25-14-16-7-5-11-33-16/h15-19,32H,3-14H2,1-2H3,(H,24,31)(H,25,30)(H,26,28)(H,27,29)/t16-,17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409247 (CHEMBL327677) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)N1CC(C)CC(C)C1)cc2)C(=O)NO Show InChI InChI=1S/C29H44N4O6/c1-18(2)12-24-23(28(36)32-38)6-5-11-39-22-9-7-21(8-10-22)14-25(31-27(24)35)29(37)30-15-26(34)33-16-19(3)13-20(4)17-33/h7-10,18-20,23-25,38H,5-6,11-17H2,1-4H3,(H,30,37)(H,31,35)(H,32,36)/t19?,20?,23-,24+,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409238 (CHEMBL91425) Show SMILES CNC(=O)[C@@H](C)NC(=O)[C@@H]1CCCCNC(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C22H39N5O7/c1-13(2)12-16-15(20(30)27-33)8-7-11-34-22(32)24-10-6-5-9-17(26-19(16)29)21(31)25-14(3)18(28)23-4/h13-17,33H,5-12H2,1-4H3,(H,23,28)(H,24,32)(H,25,31)(H,26,29)(H,27,30)/t14-,15+,16-,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409220 (CHEMBL89755) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)Nc1ccccc1)C(=O)NO Show InChI InChI=1S/C24H36N4O6/c1-16(2)15-19-18(22(30)28-33)11-8-14-34-24(32)25-13-7-6-12-20(27-21(19)29)23(31)26-17-9-4-3-5-10-17/h3-5,9-10,16,18-20,33H,6-8,11-15H2,1-2H3,(H,25,32)(H,26,31)(H,27,29)(H,28,30)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409234 (CHEMBL89045) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCC(O)CC1)C(=O)NO Show InChI InChI=1S/C25H43N5O8/c1-16(2)14-19-18(23(34)29-37)6-5-13-38-25(36)26-10-4-3-7-20(28-22(19)33)24(35)27-15-21(32)30-11-8-17(31)9-12-30/h16-20,31,37H,3-15H2,1-2H3,(H,26,36)(H,27,35)(H,28,33)(H,29,34)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409244 (CHEMBL88351) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)Nc1nc(C)cs1)C(=O)NO Show InChI InChI=1S/C25H40N6O7S/c1-15(2)12-18-17(22(34)30-37)8-7-11-38-25(36)31(4)10-6-5-9-19(28-21(18)33)23(35)26-13-20(32)29-24-27-16(3)14-39-24/h14-15,17-19,37H,5-13H2,1-4H3,(H,26,35)(H,28,33)(H,30,34)(H,27,29,32)/t17-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409225 (CHEMBL327831) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCC(O)CC1)C(=O)NO Show InChI InChI=1S/C26H45N5O8/c1-17(2)15-20-19(24(35)29-38)7-6-14-39-26(37)30(3)11-5-4-8-21(28-23(20)34)25(36)27-16-22(33)31-12-9-18(32)10-13-31/h17-21,32,38H,4-16H2,1-3H3,(H,27,36)(H,28,34)(H,29,35)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409246 (CHEMBL330249) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)N(C)C)C(=O)NO Show InChI InChI=1S/C23H41N5O7/c1-15(2)13-17-16(21(31)26-34)9-8-12-35-23(33)28(5)11-7-6-10-18(25-20(17)30)22(32)24-14-19(29)27(3)4/h15-18,34H,6-14H2,1-5H3,(H,24,32)(H,25,30)(H,26,31)/t16-,17+,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409271 (CHEMBL89374) Show SMILES CCCCCC[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)N[C@H](COC(C)(C)C)C(=O)NC)cc2)C(=O)NO Show InChI InChI=1S/C30H48N4O7/c1-6-7-8-9-11-22-23(27(36)34-39)12-10-17-40-21-15-13-20(14-16-21)18-24(32-26(22)35)29(38)33-25(28(37)31-5)19-41-30(2,3)4/h13-16,22-25,39H,6-12,17-19H2,1-5H3,(H,31,37)(H,32,35)(H,33,38)(H,34,36)/t22-,23+,24+,25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409268 (CHEMBL314428) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)Nc1nc(C)cs1)C(=O)NO Show InChI InChI=1S/C23H37N5O6S/c1-14(2)12-17-16(20(30)27-33)8-7-11-34-23(32)28(4)10-6-5-9-18(25-19(17)29)21(31)26-22-24-15(3)13-35-22/h13-14,16-18,33H,5-12H2,1-4H3,(H,25,29)(H,27,30)(H,24,26,31)/t16-,17+,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409253 (CHEMBL313936) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)NCCc1ccccn1)C(=O)NO Show InChI InChI=1S/C25H39N5O6/c1-17(2)16-20-19(23(32)30-35)9-7-15-36-25(34)28-13-6-4-10-21(29-22(20)31)24(33)27-14-11-18-8-3-5-12-26-18/h3,5,8,12,17,19-21,35H,4,6-7,9-11,13-16H2,1-2H3,(H,27,33)(H,28,34)(H,29,31)(H,30,32)/t19-,20+,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409221 (CHEMBL92535) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)N(C)C)cc2)C(=O)NO Show InChI InChI=1S/C24H36N4O6/c1-15(2)12-19-18(23(31)27-33)6-5-11-34-17-9-7-16(8-10-17)13-20(26-22(19)30)24(32)25-14-21(29)28(3)4/h7-10,15,18-20,33H,5-6,11-14H2,1-4H3,(H,25,32)(H,26,30)(H,27,31)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409292 (CHEMBL91990) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)N(C)CCCC[C@H](NC1=O)C(=O)NCC(=O)N1CCCC1)C(=O)NO Show InChI InChI=1S/C25H43N5O7/c1-17(2)15-19-18(23(33)28-36)9-8-14-37-25(35)29(3)11-5-4-10-20(27-22(19)32)24(34)26-16-21(31)30-12-6-7-13-30/h17-20,36H,4-16H2,1-3H3,(H,26,34)(H,27,32)(H,28,33)/t18-,19+,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409289 (CHEMBL2114232) Show SMILES CC(C)C[C@@H]1[C@H](CCCOC(=O)NCCCC[C@H](NC1=O)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(=O)NO Show InChI InChI=1S/C27H40N4O7/c1-16(2)14-20-19(25(34)31-37)10-7-13-38-27(36)28-12-6-5-11-21(29-24(20)33)26(35)30-23-18-9-4-3-8-17(18)15-22(23)32/h3-4,8-9,16,19-23,32,37H,5-7,10-15H2,1-2H3,(H,28,36)(H,29,33)(H,30,35)(H,31,34)/t19-,20+,21-,22+,23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409242 (CHEMBL316061) Show SMILES CNC(=O)CNC(=O)[C@@H]1CCCCN(C)C(=O)OCCC[C@@H]([C@@H](CC(C)C)C(=O)N1)C(=O)NO Show InChI InChI=1S/C22H39N5O7/c1-14(2)12-16-15(20(30)26-33)8-7-11-34-22(32)27(4)10-6-5-9-17(25-19(16)29)21(31)24-13-18(28)23-3/h14-17,33H,5-13H2,1-4H3,(H,23,28)(H,24,31)(H,25,29)(H,26,30)/t15-,16+,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409277 (CHEMBL88373) Show SMILES CC(C)C[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCC(=O)N1CCCC(C)(C)C1)cc2)C(=O)NO Show InChI InChI=1S/C29H44N4O6/c1-19(2)15-23-22(27(36)32-38)7-5-14-39-21-10-8-20(9-11-21)16-24(31-26(23)35)28(37)30-17-25(34)33-13-6-12-29(3,4)18-33/h8-11,19,22-24,38H,5-7,12-18H2,1-4H3,(H,30,37)(H,31,35)(H,32,36)/t22-,23+,24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50409269 (CHEMBL313552) Show SMILES CCCCCC[C@@H]1[C@H](CCCOc2ccc(C[C@H](NC1=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O)cc2)C(=O)NO Show InChI InChI=1S/C30H42N4O7S/c1-2-3-4-5-7-25-26(29(36)34-38)8-6-19-41-23-13-9-22(10-14-23)20-27(33-28(25)35)30(37)32-18-17-21-11-15-24(16-12-21)42(31,39)40/h9-16,25-27,38H,2-8,17-20H2,1H3,(H,32,37)(H,33,35)(H,34,36)(H2,31,39,40)/t25-,26+,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNF-alpha release in human whole blood				J Med Chem 44: 2636-60 (2001) BindingDB Entry DOI: 10.7270/Q2FB53NR
					More data for this Ligand-Target Pair

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