Compile Data Set for Download or QSAR

Found 102 hits with Last Name = 'miles-williams' and Initial = 'aj'   

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
Interstitial collagenase (Homo sapiens (Human))	BDBM50043224 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OCc1ccccc1 Show InChI InChI=1S/C27H36N2O5S/c1-18(2)14-22(24(35)16-25(30)34-17-20-8-6-5-7-9-20)26(31)29-23(27(32)28-3)15-19-10-12-21(33-4)13-11-19/h5-13,18,22-24,35H,14-17H2,1-4H3,(H,28,32)(H,29,31)/t22-,23+,24+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043221 (3-Mercapto-6-methyl-4-(1-methylcarbamoyl-2-phenyl-...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OC Show InChI InChI=1S/C20H30N2O4S/c1-13(2)10-15(17(27)12-18(23)26-4)19(24)22-16(20(25)21-3)11-14-8-6-5-7-9-14/h5-9,13,15-17,27H,10-12H2,1-4H3,(H,21,25)(H,22,24)/t15-,16+,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043231 (4-[2-(1H-Indol-3-yl)-1-methylcarbamoyl-ethylcarbam...) Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OC Show InChI InChI=1S/C22H31N3O4S/c1-13(2)9-16(19(30)11-20(26)29-4)21(27)25-18(22(28)23-3)10-14-12-24-17-8-6-5-7-15(14)17/h5-8,12-13,16,18-19,24,30H,9-11H2,1-4H3,(H,23,28)(H,25,27)/t16-,18+,19+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043228 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OC Show InChI InChI=1S/C21H32N2O5S/c1-13(2)10-16(18(29)12-19(24)28-5)20(25)23-17(21(26)22-3)11-14-6-8-15(27-4)9-7-14/h6-9,13,16-18,29H,10-12H2,1-5H3,(H,22,26)(H,23,25)/t16-,17+,18+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043227 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OC(C)(C)C Show InChI InChI=1S/C24H38N2O5S/c1-15(2)12-18(20(32)14-21(27)31-24(3,4)5)22(28)26-19(23(29)25-6)13-16-8-10-17(30-7)11-9-16/h8-11,15,18-20,32H,12-14H2,1-7H3,(H,25,29)(H,26,28)/t18-,19+,20+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50450368 (CHEMBL2115216) Show SMILES CC(C)CC(CC(=O)NO)C(=O)N[C@H]1CCCCNCCCCCNC1=O |r| Show InChI InChI=1S/C19H36N4O4/c1-14(2)12-15(13-17(24)23-27)18(25)22-16-8-4-7-10-20-9-5-3-6-11-21-19(16)26/h14-16,20,27H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,24)/t15?,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043237 (4-[2-(1H-Indol-3-yl)-1-methylcarbamoyl-ethylcarbam...) Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CC(C)C)[C@H](S)CC(=O)OC Show InChI InChI=1S/C22H31N3O4S/c1-13(2)9-16(19(30)11-20(26)29-4)21(27)25-18(22(28)23-3)10-14-12-24-17-8-6-5-7-15(14)17/h5-8,12-13,16,18-19,24,30H,9-11H2,1-4H3,(H,23,28)(H,25,27)/t16-,18-,19+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50450368 (CHEMBL2115216) Show SMILES CC(C)CC(CC(=O)NO)C(=O)N[C@H]1CCCCNCCCCCNC1=O |r| Show InChI InChI=1S/C19H36N4O4/c1-14(2)12-15(13-17(24)23-27)18(25)22-16-8-4-7-10-20-9-5-3-6-11-21-19(16)26/h14-16,20,27H,3-13H2,1-2H3,(H,21,26)(H,22,25)(H,23,24)/t15?,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043222 (4-(2-Benzyloxy-1-methylcarbamoyl-propylcarbamoyl)-...) Show SMILES CNC(=O)[C@@H](NC(=O)C(CC(C)C)C(S)CC(=O)OC)C(C)OCc1ccccc1 Show InChI InChI=1S/C22H34N2O5S/c1-14(2)11-17(18(30)12-19(25)28-5)21(26)24-20(22(27)23-4)15(3)29-13-16-9-7-6-8-10-16/h6-10,14-15,17-18,20,30H,11-13H2,1-5H3,(H,23,27)(H,24,26)/t15?,17?,18?,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043222 (4-(2-Benzyloxy-1-methylcarbamoyl-propylcarbamoyl)-...) Show SMILES CNC(=O)[C@@H](NC(=O)C(CC(C)C)C(S)CC(=O)OC)C(C)OCc1ccccc1 Show InChI InChI=1S/C22H34N2O5S/c1-14(2)11-17(18(30)12-19(25)28-5)21(26)24-20(22(27)23-4)15(3)29-13-16-9-7-6-8-10-16/h6-10,14-15,17-18,20,30H,11-13H2,1-5H3,(H,23,27)(H,24,26)/t15?,17?,18?,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043235 (2-(1-Mercapto-ethyl)-4-methyl-pentanoic acid [2-(4...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)C(C)S Show InChI InChI=1S/C19H30N2O3S/c1-12(2)10-16(13(3)25)18(22)21-17(19(23)20-4)11-14-6-8-15(24-5)9-7-14/h6-9,12-13,16-17,25H,10-11H2,1-5H3,(H,20,23)(H,21,22)/t13?,16?,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286132 ((S)-2-((S)-1-Mercapto-ethyl)-4-methyl-pentanoic ac...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@H](C)S Show InChI InChI=1S/C19H30N2O3S/c1-12(2)10-16(13(3)25)18(22)21-17(19(23)20-4)11-14-6-8-15(24-5)9-7-14/h6-9,12-13,16-17,25H,10-11H2,1-5H3,(H,20,23)(H,21,22)/t13-,16+,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043242 (3-Acetylsulfanyl-4-[2-(1H-indol-3-yl)-1-methylcarb...) Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@H](CC(=O)OC)SC(C)=O Show InChI InChI=1S/C24H33N3O5S/c1-14(2)10-18(21(33-15(3)28)12-22(29)32-5)23(30)27-20(24(31)25-4)11-16-13-26-19-9-7-6-8-17(16)19/h6-9,13-14,18,20-21,26H,10-12H2,1-5H3,(H,25,31)(H,27,30)/t18-,20+,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50283786 (CHEMBL328917 | {(R)-3-(6-Bromo-1,3-dioxo-1H,3H-ben...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@@H](CCN1C(=O)c2cccc3c(Br)ccc(C1=O)c23)P(O)(O)=O Show InChI InChI=1S/C31H36BrN4O7P/c1-18(2)16-24(29(38)35-25(28(37)33-3)17-19-8-5-4-6-9-19)34-26(44(41,42)43)14-15-36-30(39)21-11-7-10-20-23(32)13-12-22(27(20)21)31(36)40/h4-13,18,24-26,34H,14-17H2,1-3H3,(H,33,37)(H,35,38)(H2,41,42,43)/t24-,25-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043231 (4-[2-(1H-Indol-3-yl)-1-methylcarbamoyl-ethylcarbam...) Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OC Show InChI InChI=1S/C22H31N3O4S/c1-13(2)9-16(19(30)11-20(26)29-4)21(27)25-18(22(28)23-3)10-14-12-24-17-8-6-5-7-15(14)17/h5-8,12-13,16,18-19,24,30H,9-11H2,1-4H3,(H,23,28)(H,25,27)/t16-,18+,19+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase without beta-mercaptoethanol				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043223 (4-[2-(1H-Indol-3-yl)-1-methylcarbamoyl-ethylcarbam...) Show SMILES CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)[C@H](CC(=O)OC)SS[C@@H](CC(=O)OC)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC Show InChI InChI=1S/C44H60N6O8S2/c1-25(2)17-31(41(53)49-35(43(55)45-5)19-27-23-47-33-15-11-9-13-29(27)33)37(21-39(51)57-7)59-60-38(22-40(52)58-8)32(18-26(3)4)42(54)50-36(44(56)46-6)20-28-24-48-34-16-12-10-14-30(28)34/h9-16,23-26,31-32,35-38,47-48H,17-22H2,1-8H3,(H,45,55)(H,46,56)(H,49,53)(H,50,54)/t31-,32-,35+,36+,37+,38+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043238 (2-Isobutyl-3-mercapto-pentanedioic acid 5-amide 1-...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(N)=O Show InChI InChI=1S/C20H31N3O4S/c1-12(2)9-15(17(28)11-18(21)24)19(25)23-16(20(26)22-3)10-13-5-7-14(27-4)8-6-13/h5-8,12,15-17,28H,9-11H2,1-4H3,(H2,21,24)(H,22,26)(H,23,25)/t15-,16+,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043230 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(O)=O Show InChI InChI=1S/C20H30N2O5S/c1-12(2)9-15(17(28)11-18(23)24)19(25)22-16(20(26)21-3)10-13-5-7-14(27-4)8-6-13/h5-8,12,15-17,28H,9-11H2,1-4H3,(H,21,26)(H,22,25)(H,23,24)/t15-,16+,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285719 (CHEMBL315898 | N*4*-Hydroxy-2-isobutyl-N*1*-(2-oxo...) Show SMILES CC(C)CC(CC(=O)NO)C(=O)NC1CCCCCCCCCCNC1=O Show InChI InChI=1S/C20H37N3O4/c1-15(2)13-16(14-18(24)23-27)19(25)22-17-11-9-7-5-3-4-6-8-10-12-21-20(17)26/h15-17,27H,3-14H2,1-2H3,(H,21,26)(H,22,25)(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043229 (CHEMBL130164 | {3-Mercapto-4-[2-(4-methoxy-phenyl)...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)NCC(O)=O Show InChI InChI=1S/C22H33N3O6S/c1-13(2)9-16(18(32)11-19(26)24-12-20(27)28)21(29)25-17(22(30)23-3)10-14-5-7-15(31-4)8-6-14/h5-8,13,16-18,32H,9-12H2,1-4H3,(H,23,30)(H,24,26)(H,25,29)(H,27,28)/t16-,17+,18+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286139 ((S)-2-(2-Mercapto-benzyl)-4-methyl-pentanoic acid ...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)Cc1ccccc1S Show InChI InChI=1S/C23H30N2O2S/c1-16(2)13-19(15-18-11-7-8-12-21(18)28)22(26)25-20(23(27)24-3)14-17-9-5-4-6-10-17/h4-12,16,19-20,28H,13-15H2,1-3H3,(H,24,27)(H,25,26)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50283785 (CHEMBL98233 | {(R)-3-(1,3-Dioxo-1H,3H-benzo[de]iso...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@@H](CCN1C(=O)c2cccc3cccc(C1=O)c23)P(O)(O)=O Show InChI InChI=1S/C31H37N4O7P/c1-19(2)17-24(29(37)34-25(28(36)32-3)18-20-9-5-4-6-10-20)33-26(43(40,41)42)15-16-35-30(38)22-13-7-11-21-12-8-14-23(27(21)22)31(35)39/h4-14,19,24-26,33H,15-18H2,1-3H3,(H,32,36)(H,34,37)(H2,40,41,42)/t24-,25-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043243 (2-Isobutyl-3-mercapto-pentanedioic acid 5-carbamoy...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)NCC(N)=O Show InChI InChI=1S/C22H34N4O5S/c1-13(2)9-16(18(32)11-20(28)25-12-19(23)27)21(29)26-17(22(30)24-3)10-14-5-7-15(31-4)8-6-14/h5-8,13,16-18,32H,9-12H2,1-4H3,(H2,23,27)(H,24,30)(H,25,28)(H,26,29)/t16-,17+,18+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043232 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@@H](CC(C)C)[C@H](S)CC(=O)OCc1ccccc1 Show InChI InChI=1S/C27H36N2O5S/c1-18(2)14-22(24(35)16-25(30)34-17-20-8-6-5-7-9-20)26(31)29-23(27(32)28-3)15-19-10-12-21(33-4)13-11-19/h5-13,18,22-24,35H,14-17H2,1-4H3,(H,28,32)(H,29,31)/t22-,23-,24+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043220 (3-Acetylsulfanyl-4-[2-(4-methoxy-phenyl)-1-methylc...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@H](CC(=O)OC)SC(C)=O Show InChI InChI=1S/C23H34N2O6S/c1-14(2)11-18(20(32-15(3)26)13-21(27)31-6)22(28)25-19(23(29)24-4)12-16-7-9-17(30-5)10-8-16/h7-10,14,18-20H,11-13H2,1-6H3,(H,24,29)(H,25,28)/t18-,19+,20+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285715 ((S)-3-Mercapto-6-methyl-4-(8-oxo-1,7diaza-cyclotri...) Show SMILES CC(C)CC([C@@H](S)CC(=O)OC(C)C)C(=O)NC1CCCCNCCCCCNC1=O |r| Show InChI InChI=1S/C23H43N3O4S/c1-16(2)14-18(20(31)15-21(27)30-17(3)4)22(28)26-19-10-6-9-12-24-11-7-5-8-13-25-23(19)29/h16-20,24,31H,5-15H2,1-4H3,(H,25,29)(H,26,28)/t18?,19?,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043734 (((R)-1-{(S)-1-[(S)-2-(1H-Indol-3-yl)-1-methylcarba...) Show SMILES CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C21H33N4O5P/c1-5-19(31(28,29)30)24-17(10-13(2)3)21(27)25-18(20(26)22-4)11-14-12-23-16-9-7-6-8-15(14)16/h6-9,12-13,17-19,23-24H,5,10-11H2,1-4H3,(H,22,26)(H,25,27)(H2,28,29,30)/t17-,18-,19+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase				J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285716 (3-Mercapto-6-methyl-4-(2-oxo-azacyclotridec-3-ylca...) Show SMILES CC(C)C[C@H]([C@@H](S)CC(=O)OC(C)C)C(=O)NC1CCCCCCCCCCNC1=O Show InChI InChI=1S/C24H44N2O4S/c1-17(2)15-19(21(31)16-22(27)30-18(3)4)23(28)26-20-13-11-9-7-5-6-8-10-12-14-25-24(20)29/h17-21,31H,5-16H2,1-4H3,(H,25,29)(H,26,28)/t19-,20?,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286135 ((S)-2-(2-Mercapto-benzyl)-4-methyl-pentanoic acid ...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@@H](CC(C)C)Cc1ccccc1S Show InChI InChI=1S/C24H32N2O3S/c1-16(2)13-19(15-18-7-5-6-8-22(18)30)23(27)26-21(24(28)25-3)14-17-9-11-20(29-4)12-10-17/h5-12,16,19,21,30H,13-15H2,1-4H3,(H,25,28)(H,26,27)/t19-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043224 (3-Mercapto-4-[2-(4-methoxy-phenyl)-1-methylcarbamo...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)OCc1ccccc1 Show InChI InChI=1S/C27H36N2O5S/c1-18(2)14-22(24(35)16-25(30)34-17-20-8-6-5-7-9-20)26(31)29-23(27(32)28-3)15-19-10-12-21(33-4)13-11-19/h5-13,18,22-24,35H,14-17H2,1-4H3,(H,28,32)(H,29,31)/t22-,23+,24+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of rat skin type I collagen degradation by purified human lung fibroblast collagenase without beta-mercaptoethanol				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043225 (2-Isobutyl-3-mercapto-5-(4-methyl-piperazin-1-yl)-...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)N1CCN(C)CC1 Show InChI InChI=1S/C25H40N4O4S/c1-17(2)14-20(22(34)16-23(30)29-12-10-28(4)11-13-29)24(31)27-21(25(32)26-3)15-18-6-8-19(33-5)9-7-18/h6-9,17,20-22,34H,10-16H2,1-5H3,(H,26,32)(H,27,31)/t20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286133 (2-(2-Mercapto-4-methoxy-benzyl)-4-methyl-pentanoic...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)Cc1ccc(OC)cc1S Show InChI InChI=1S/C25H34N2O4S/c1-16(2)12-19(14-18-8-11-21(31-5)15-23(18)32)24(28)27-22(25(29)26-3)13-17-6-9-20(30-4)10-7-17/h6-11,15-16,19,22,32H,12-14H2,1-5H3,(H,26,29)(H,27,28)/t19?,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043234 (2-Isobutyl-3-mercapto-pentanedioic acid 1-{[2-(4-m...) Show SMILES CNC(=O)C[C@H](S)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)NC Show InChI InChI=1S/C21H33N3O4S/c1-13(2)10-16(18(29)12-19(25)22-3)20(26)24-17(21(27)23-4)11-14-6-8-15(28-5)9-7-14/h6-9,13,16-18,29H,10-12H2,1-5H3,(H,22,25)(H,23,27)(H,24,26)/t16-,17+,18+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	145	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50283783 (CHEMBL330729 | {(S)-3-(1,3-Dioxo-1H,3H-benzo[de]is...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@H](CCN1C(=O)c2cccc3cccc(C1=O)c23)P(O)(O)=O Show InChI InChI=1S/C31H37N4O7P/c1-19(2)17-24(29(37)34-25(28(36)32-3)18-20-9-5-4-6-10-20)33-26(43(40,41)42)15-16-35-30(38)22-13-7-11-21-12-8-14-23(27(21)22)31(35)39/h4-14,19,24-26,33H,15-18H2,1-3H3,(H,32,36)(H,34,37)(H2,40,41,42)/t24-,25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043733 (((R)-1-{(S)-1-[(S)-2-(1H-Benzoimidazol-2-yl)-1-met...) Show SMILES CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1nc2ccccc2[nH]1)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C20H32N5O5P/c1-5-18(31(28,29)30)24-15(10-12(2)3)20(27)25-16(19(26)21-4)11-17-22-13-8-6-7-9-14(13)23-17/h6-9,12,15-16,18,24H,5,10-11H2,1-4H3,(H,21,26)(H,22,23)(H,25,27)(H2,28,29,30)/t15-,16-,18+/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	150	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase				J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286128 ((S)-2-(2-Mercapto-3-methoxy-benzyl)-4-methyl-penta...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@@H](CC(C)C)Cc1cccc(OC)c1S Show InChI InChI=1S/C25H34N2O4S/c1-16(2)13-19(15-18-7-6-8-22(31-5)23(18)32)24(28)27-21(25(29)26-3)14-17-9-11-20(30-4)12-10-17/h6-12,16,19,21,32H,13-15H2,1-5H3,(H,26,29)(H,27,28)/t19-,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285717 (CHEMBL87377 | {1-[3-Methyl-1-(2-oxo-azacyclotridec...) Show SMILES CCC(N[C@@H](CC(C)C)C(=O)NC1CCCCCCCCCCNC1=O)P(O)(O)=O Show InChI InChI=1S/C21H42N3O5P/c1-4-19(30(27,28)29)23-18(15-16(2)3)21(26)24-17-13-11-9-7-5-6-8-10-12-14-22-20(17)25/h16-19,23H,4-15H2,1-3H3,(H,22,25)(H,24,26)(H2,27,28,29)/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	Article	n/a	n/a	183	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043233 (4-(1-Carbamoyl-2-phenyl-ethylcarbamoyl)-3-mercapto...) Show SMILES COC(=O)C[C@H](S)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C19H28N2O4S/c1-12(2)9-14(16(26)11-17(22)25-3)19(24)21-15(18(20)23)10-13-7-5-4-6-8-13/h4-8,12,14-16,26H,9-11H2,1-3H3,(H2,20,23)(H,21,24)/t14-,15+,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50283779 (CHEMBL96018 | {(R)-3-(1,3-Dioxo-1,3-dihydro-isoind...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)N[C@@H](CCN1C(=O)c2ccccc2C1=O)P(O)(O)=O Show InChI InChI=1S/C27H35N4O7P/c1-17(2)15-21(25(33)30-22(24(32)28-3)16-18-9-5-4-6-10-18)29-23(39(36,37)38)13-14-31-26(34)19-11-7-8-12-20(19)27(31)35/h4-12,17,21-23,29H,13-16H2,1-3H3,(H,28,32)(H,30,33)(H2,36,37,38)/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	Article	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043233 (4-(1-Carbamoyl-2-phenyl-ethylcarbamoyl)-3-mercapto...) Show SMILES COC(=O)C[C@H](S)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C19H28N2O4S/c1-12(2)9-14(16(26)11-17(22)25-3)19(24)21-15(18(20)23)10-13-7-5-4-6-8-13/h4-8,12,14-16,26H,9-11H2,1-3H3,(H2,20,23)(H,21,24)/t14-,15+,16+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286129 ((R)-2-(2-Mercapto-3-methoxy-benzyl)-4-methyl-penta...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)Cc1cccc(OC)c1S Show InChI InChI=1S/C25H34N2O4S/c1-16(2)13-19(15-18-7-6-8-22(31-5)23(18)32)24(28)27-21(25(29)26-3)14-17-9-11-20(30-4)12-10-17/h6-12,16,19,21,32H,13-15H2,1-5H3,(H,26,29)(H,27,28)/t19-,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285722 (CHEMBL3142558 | CHEMBL86483 | {(R)-1-[3-Methyl-1-(...) Show SMILES CC[C@H](N[C@@H](CC(C)C)C(=O)NC1CCCNCCCCCCNC1=O)P(O)(O)=O Show InChI InChI=1S/C20H41N4O5P/c1-4-18(30(27,28)29)23-17(14-15(2)3)20(26)24-16-10-9-12-21-11-7-5-6-8-13-22-19(16)25/h15-18,21,23H,4-14H2,1-3H3,(H,22,25)(H,24,26)(H2,27,28,29)/t16?,17?,18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	227	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of semi-purified human lung fibroblast collagenase				Bioorg Med Chem Lett 5: 2593-2598 (1995) Article DOI: 10.1016/0960-894X(95)00471-5 BindingDB Entry DOI: 10.7270/Q2MK6CWJ
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043745 (CHEMBL47907 | {(R)-1-[(S)-3-Methyl-1-((S)-1-methyl...) Show SMILES CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C19H32N3O5P/c1-5-17(28(25,26)27)21-15(11-13(2)3)19(24)22-16(18(23)20-4)12-14-9-7-6-8-10-14/h6-10,13,15-17,21H,5,11-12H2,1-4H3,(H,20,23)(H,22,24)(H2,25,26,27)/t15-,16-,17+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286138 (2-(4-Chloro-2-mercapto-benzyl)-4-methyl-pentanoic ...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)Cc1ccc(Cl)cc1S Show InChI InChI=1S/C24H31ClN2O3S/c1-15(2)11-18(13-17-7-8-19(25)14-22(17)31)23(28)27-21(24(29)26-3)12-16-5-9-20(30-4)10-6-16/h5-10,14-15,18,21,31H,11-13H2,1-4H3,(H,26,29)(H,27,28)/t18?,21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043745 (CHEMBL47907 | {(R)-1-[(S)-3-Methyl-1-((S)-1-methyl...) Show SMILES CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C19H32N3O5P/c1-5-17(28(25,26)27)21-15(11-13(2)3)19(24)22-16(18(23)20-4)12-14-9-7-6-8-10-14/h6-10,13,15-17,21H,5,11-12H2,1-4H3,(H,20,23)(H,22,24)(H2,25,26,27)/t15-,16-,17+/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	230	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase				J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043755 (CHEMBL416095 | {(S)-1-[(S)-3-Methyl-1-((S)-1-methy...) Show SMILES CC[C@@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C19H32N3O5P/c1-5-17(28(25,26)27)21-15(11-13(2)3)19(24)22-16(18(23)20-4)12-14-9-7-6-8-10-14/h6-10,13,15-17,21H,5,11-12H2,1-4H3,(H,20,23)(H,22,24)(H2,25,26,27)/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	Article	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human fibroblast collagenase				Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043755 (CHEMBL416095 | {(S)-1-[(S)-3-Methyl-1-((S)-1-methy...) Show SMILES CC[C@@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC)P(O)(O)=O Show InChI InChI=1S/C19H32N3O5P/c1-5-17(28(25,26)27)21-15(11-13(2)3)19(24)22-16(18(23)20-4)12-14-9-7-6-8-10-14/h6-10,13,15-17,21H,5,11-12H2,1-4H3,(H,20,23)(H,22,24)(H2,25,26,27)/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	240	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase				J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043732 (((S)-1-{(S)-1-[(S)-2-(4-Methoxy-phenyl)-1-methylca...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)N[C@H](C)P(O)(O)=O Show InChI InChI=1S/C19H32N3O6P/c1-12(2)10-16(21-13(3)29(25,26)27)19(24)22-17(18(23)20-4)11-14-6-8-15(28-5)9-7-14/h6-9,12-13,16-17,21H,10-11H2,1-5H3,(H,20,23)(H,22,24)(H2,25,26,27)/t13-,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	260	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase				J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50286130 ((S)-2-((R)-Mercapto-phenyl-methyl)-4-methyl-pentan...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)c1ccccc1 Show InChI InChI=1S/C24H32N2O3S/c1-16(2)14-20(22(30)18-8-6-5-7-9-18)23(27)26-21(24(28)25-3)15-17-10-12-19(29-4)13-11-17/h5-13,16,20-22,30H,14-15H2,1-4H3,(H,25,28)(H,26,27)/t20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity was tested against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 3039-3042 (1995) Article DOI: 10.1016/0960-894X(95)00531-2 BindingDB Entry DOI: 10.7270/Q2MC8ZZ5
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50043240 (CHEMBL128406 | {3-Mercapto-4-[2-(4-methoxy-phenyl)...) Show SMILES CNC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](CC(C)C)[C@@H](S)CC(=O)NCC(=O)OC(C)(C)C Show InChI InChI=1S/C26H41N3O6S/c1-16(2)12-19(21(36)14-22(30)28-15-23(31)35-26(3,4)5)24(32)29-20(25(33)27-6)13-17-8-10-18(34-7)11-9-17/h8-11,16,19-21,36H,12-15H2,1-7H3,(H,27,33)(H,28,30)(H,29,32)/t19-,20+,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of radiolabeled rat skin type I collagen degradation by purified human lung fibroblast collagenase.				J Med Chem 36: 4030-9 (1994) BindingDB Entry DOI: 10.7270/Q2028QM3
					More data for this Ligand-Target Pair

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