BDBM50183732 CHEMBL205900::N-(1-(4,5-dihydrothiazol-2-yl)-4-(2-(hydroxyamino)-2-oxoethyl)piperidin-4-yl)-4-((2-methylquinolin-4-yl)methoxy)benzamide

SMILES: Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1

InChI Key: InChIKey=XNQVZVNWVMQCPC-UHFFFAOYSA-N

Data: 4 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50183732   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP9				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>3.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP2				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>4.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP1				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>5.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP13				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
ADAM17 (Sus scrofa (pig))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of porcine TACE				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50183732 (CHEMBL205900 | N-(1-(4,5-dihydrothiazol-2-yl)-4-(2...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(CC2)C2=NCCS2)c2ccccc2n1 |t:28| Show InChI InChI=1S/C28H31N5O4S/c1-19-16-21(23-4-2-3-5-24(23)30-19)18-37-22-8-6-20(7-9-22)26(35)31-28(17-25(34)32-36)10-13-33(14-11-28)27-29-12-15-38-27/h2-9,16,36H,10-15,17-18H2,1H3,(H,31,35)(H,32,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNFalpha production in human whole blood				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair