BDBM50131661 CHEMBL116944::N-(3-Hydroxycarbamoyl-1-hydroxymethyl-butyl)-4-phenoxy-benzamide

SMILES: C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO

InChI Key: InChIKey=BLBHPKKKTVUSPA-ZFWWWQNUSA-N

Data: 3 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 3 hits for monomerid = 50131661   

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))	BDBM50131661 (CHEMBL116944 | N-(3-Hydroxycarbamoyl-1-hydroxymeth...) Show SMILES C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO Show InChI InChI=1S/C19H22N2O5/c1-13(18(23)21-25)11-15(12-22)20-19(24)14-7-9-17(10-8-14)26-16-5-3-2-4-6-16/h2-10,13,15,22,25H,11-12H2,1H3,(H,20,24)(H,21,23)/t13-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
National Cardiovascular Center Research Institute Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-9 (MMP-9)				J Med Chem 46: 3497-501 (2003) Article DOI: 10.1021/jm020356g BindingDB Entry DOI: 10.7270/Q2862FT2
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50131661 (CHEMBL116944 | N-(3-Hydroxycarbamoyl-1-hydroxymeth...) Show SMILES C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO Show InChI InChI=1S/C19H22N2O5/c1-13(18(23)21-25)11-15(12-22)20-19(24)14-7-9-17(10-8-14)26-16-5-3-2-4-6-16/h2-10,13,15,22,25H,11-12H2,1H3,(H,20,24)(H,21,23)/t13-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	0.650	n/a	n/a	n/a	n/a	n/a	n/a
National Cardiovascular Center Research Institute Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-2 (MMP-2)				J Med Chem 46: 3497-501 (2003) Article DOI: 10.1021/jm020356g BindingDB Entry DOI: 10.7270/Q2862FT2
					More data for this Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12) (Homo sapiens (Human))	BDBM50131661 (CHEMBL116944 | N-(3-Hydroxycarbamoyl-1-hydroxymeth...) Show SMILES C[C@@H](C[C@@H](CO)NC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NO Show InChI InChI=1S/C19H22N2O5/c1-13(18(23)21-25)11-15(12-22)20-19(24)14-7-9-17(10-8-14)26-16-5-3-2-4-6-16/h2-10,13,15,22,25H,11-12H2,1H3,(H,20,24)(H,21,23)/t13-,15-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
National Cardiovascular Center Research Institute Curated by ChEMBL					Assay Description Inhibition of human Matrix metalloprotease-12 (MMP-12)				J Med Chem 46: 3497-501 (2003) Article DOI: 10.1021/jm020356g BindingDB Entry DOI: 10.7270/Q2862FT2
					More data for this Ligand-Target Pair