Compile Data Set for Download or QSAR

Found 128 hits with Last Name = 'miles-williams' and Initial = 'a'   

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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50354851 (FLUTICASONE FUROATE | Veramyst) Show SMILES C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)SCF |r,c:12,t:8| Show InChI InChI=1S/C27H29F3O6S/c1-14-9-16-17-11-19(29)18-10-15(31)6-7-24(18,2)26(17,30)21(32)12-25(16,3)27(14,23(34)37-13-28)36-22(33)20-5-4-8-35-20/h4-8,10,14,16-17,19,21,32H,9,11-13H2,1-3H3/t14-,16+,17+,19+,21+,24+,25+,26+,27+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents	DrugBank PDB Article PubMed	n/a	n/a	0.0398	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414604 (CHEMBL551816) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(Cl)cccc1Cl Show InChI InChI=1S/C26H22Cl2F4N4O2/c1-2-35(24(37)23-19(27)5-3-6-20(23)28)15-25(38,26(30,31)32)14-33-21-7-4-8-22-18(21)13-34-36(22)17-11-9-16(29)10-12-17/h3-13,33,38H,2,14-15H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.0790	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414609 (CHEMBL550730) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C26H23F5N4O2/c1-2-34(24(36)19-6-3-4-7-21(19)28)16-25(37,26(29,30)31)15-32-22-8-5-9-23-20(22)14-33-35(23)18-12-10-17(27)11-13-18/h3-14,32,37H,2,15-16H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.126	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414610 (CHEMBL564160) Show SMILES CCN(CC(O)(CNc1cc(C)cc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C27H25F5N4O2/c1-3-35(25(37)20-6-4-5-7-22(20)29)16-26(38,27(30,31)32)15-33-23-12-17(2)13-24-21(23)14-34-36(24)19-10-8-18(28)9-11-19/h4-14,33,38H,3,15-16H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414607 (CHEMBL563812) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1Cl Show InChI InChI=1S/C26H23ClF4N4O2/c1-2-34(24(36)19-6-3-4-7-21(19)27)16-25(37,26(29,30)31)15-32-22-8-5-9-23-20(22)14-33-35(23)18-12-10-17(28)11-13-18/h3-14,32,37H,2,15-16H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.251	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414611 (CHEMBL560797) Show SMILES CCN(CC(O)(CNc1cc(C)cc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C27H26F4N4O2/c1-3-34(25(36)20-11-7-8-12-22(20)28)17-26(37,27(29,30)31)16-32-23-13-18(2)14-24-21(23)15-33-35(24)19-9-5-4-6-10-19/h4-15,32,37H,3,16-17H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.251	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414605 (CHEMBL556231) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(F)cccc1F Show InChI InChI=1S/C26H22F6N4O2/c1-2-35(24(37)23-19(28)5-3-6-20(23)29)15-25(38,26(30,31)32)14-33-21-7-4-8-22-18(21)13-34-36(22)17-11-9-16(27)10-12-17/h3-13,33,38H,2,14-15H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.316	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414612 (CHEMBL559115) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C26H24F4N4O2/c1-2-33(24(35)19-11-6-7-12-21(19)27)17-25(36,26(28,29)30)16-31-22-13-8-14-23-20(22)15-32-34(23)18-9-4-3-5-10-18/h3-15,31,36H,2,16-17H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.316	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414608 (CHEMBL550933) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1C Show InChI InChI=1S/C27H26F4N4O2/c1-3-34(25(36)21-8-5-4-7-18(21)2)17-26(37,27(29,30)31)16-32-23-9-6-10-24-22(23)15-33-35(24)20-13-11-19(28)12-14-20/h4-15,32,37H,3,16-17H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.316	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414613 (CHEMBL561475) Show SMILES CCN(CC(O)(CNc1cc(C)cc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C27H26F4N4O2/c1-3-34(25(36)19-7-5-4-6-8-19)17-26(37,27(29,30)31)16-32-23-13-18(2)14-24-22(23)15-33-35(24)21-11-9-20(28)10-12-21/h4-15,32,37H,3,16-17H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.398	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414615 (CHEMBL559942) Show SMILES CCN(CC(O)(CNc1cc(C)cc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C27H27F3N4O2/c1-3-33(25(35)20-10-6-4-7-11-20)18-26(36,27(28,29)30)17-31-23-14-19(2)15-24-22(23)16-32-34(24)21-12-8-5-9-13-21/h4-16,31,36H,3,17-18H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.398	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414606 (CHEMBL550258) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(C)cccc1C Show InChI InChI=1S/C28H28F4N4O2/c1-4-35(26(37)25-18(2)7-5-8-19(25)3)17-27(38,28(30,31)32)16-33-23-9-6-10-24-22(23)15-34-36(24)21-13-11-20(29)12-14-21/h5-15,33,38H,4,16-17H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.501	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414618 (CHEMBL563595) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C26H25F3N4O2/c1-2-32(24(34)19-10-5-3-6-11-19)18-25(35,26(27,28)29)17-30-22-14-9-15-23-21(22)16-31-33(23)20-12-7-4-8-13-20/h3-16,30,35H,2,17-18H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.794	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414614 (CHEMBL561276) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C26H24F4N4O2/c1-2-33(24(35)18-7-4-3-5-8-18)17-25(36,26(28,29)30)16-31-22-9-6-10-23-21(22)15-32-34(23)20-13-11-19(27)12-14-20/h3-15,31,36H,2,16-17H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.794	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM18207 ((1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dih...) Show SMILES [H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C |c:28,t:24| Show InChI InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair				3D Structure (crystal)
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414623 (CHEMBL394168) Show SMILES CCC1(CC(O)(CNC(=O)c2cnn(c2N)-c2ccccc2)C(F)(F)F)CCCc2ccccc12 Show InChI InChI=1S/C26H29F3N4O2/c1-2-24(14-8-10-18-9-6-7-13-21(18)24)16-25(35,26(27,28)29)17-31-23(34)20-15-32-33(22(20)30)19-11-4-3-5-12-19/h3-7,9,11-13,15,35H,2,8,10,14,16-17,30H2,1H3,(H,31,34)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					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	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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414619 (CHEMBL559547) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H25F3N4O3S/c1-2-31(36(34,35)20-12-7-4-8-13-20)18-24(33,25(26,27)28)17-29-22-14-9-15-23-21(22)16-30-32(23)19-10-5-3-6-11-19/h3-16,29,33H,2,17-18H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.51	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414616 (CHEMBL558716) Show SMILES CCCN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C27H27F3N4O2/c1-2-16-33(25(35)20-10-5-3-6-11-20)19-26(36,27(28,29)30)18-31-23-14-9-15-24-22(23)17-32-34(24)21-12-7-4-8-13-21/h3-15,17,31,36H,2,16,18-19H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.16	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414617 (CHEMBL559742) Show SMILES CN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)C(=O)c1ccccc1 Show InChI InChI=1S/C25H23F3N4O2/c1-31(23(33)18-9-4-2-5-10-18)17-24(34,25(26,27)28)16-29-21-13-8-14-22-20(21)15-30-32(22)19-11-6-3-7-12-19/h2-15,29,34H,16-17H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.01	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414620 (CHEMBL559546) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 Show InChI InChI=1S/C25H24F4N4O3S/c1-2-32(37(35,36)20-13-11-18(26)12-14-20)17-24(34,25(27,28)29)16-30-22-9-6-10-23-21(22)15-31-33(23)19-7-4-3-5-8-19/h3-15,30,34H,2,16-17H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.94	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414604 (CHEMBL551816) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(Cl)cccc1Cl Show InChI InChI=1S/C26H22Cl2F4N4O2/c1-2-35(24(37)23-19(27)5-3-6-20(23)28)15-25(38,26(30,31)32)14-33-21-7-4-8-22-18(21)13-34-36(22)17-11-9-16(29)10-12-17/h3-13,33,38H,2,14-15H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414604 (CHEMBL551816) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1c(Cl)cccc1Cl Show InChI InChI=1S/C26H22Cl2F4N4O2/c1-2-35(24(37)23-19(27)5-3-6-20(23)28)15-25(38,26(30,31)32)14-33-21-7-4-8-22-18(21)13-34-36(22)17-11-9-16(29)10-12-17/h3-13,33,38H,2,14-15H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					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))	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))	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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414621 (CHEMBL562337) Show SMILES CCN(CC(O)(CNc1nc(C)nc2n(ncc12)-c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 Show InChI InChI=1S/C24H24F4N6O3S/c1-3-33(38(36,37)19-11-9-17(25)10-12-19)15-23(35,24(26,27)28)14-29-21-20-13-30-34(18-7-5-4-6-8-18)22(20)32-16(2)31-21/h4-13,35H,3,14-15H2,1-2H3,(H,29,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	25.1	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					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))	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))	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
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414609 (CHEMBL550730) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C26H23F5N4O2/c1-2-34(24(36)19-6-3-4-7-21(19)28)16-25(37,26(29,30)31)15-32-22-8-5-9-23-20(22)14-33-35(23)18-12-10-17(27)11-13-18/h3-14,32,37H,2,15-16H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31.6	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414622 (CHEMBL564332) Show SMILES CCN(CC(O)(CNC(=O)c1cnn(c1N)-c1ccccc1)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 Show InChI InChI=1S/C22H23F4N5O4S/c1-2-30(36(34,35)17-10-8-15(23)9-11-17)14-21(33,22(24,25)26)13-28-20(32)18-12-29-31(19(18)27)16-6-4-3-5-7-16/h3-12,33H,2,13-14,27H2,1H3,(H,28,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	31.6	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50414609 (CHEMBL550730) Show SMILES CCN(CC(O)(CNc1cccc2n(ncc12)-c1ccc(F)cc1)C(F)(F)F)C(=O)c1ccccc1F Show InChI InChI=1S/C26H23F5N4O2/c1-2-34(24(36)19-6-3-4-7-21(19)28)16-25(37,26(29,30)31)15-32-22-8-5-9-23-20(22)14-33-35(23)18-12-10-17(27)11-13-18/h3-14,32,37H,2,15-16H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31.6	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonist activity at GR in human A549 cells by NF-kappaB transrepression assay				Bioorg Med Chem Lett 19: 4846-50 (2009) Article DOI: 10.1016/j.bmcl.2009.06.020 BindingDB Entry DOI: 10.7270/Q2RR20HH
					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

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