BDBM50371352 CHEMBL438528

SMILES: Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2C(=O)NO)c2ccccc2n1

InChI Key: InChIKey=BVFWOEMSVMBUTK-RBDMOPTHSA-N

Data: 3 KI  1 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 4 hits for monomerid = 50371352   

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))	BDBM50371352 (CHEMBL438528) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2C(=O)NO)c2ccccc2n1 Show InChI InChI=1S/C24H25N3O5/c1-14-10-16(19-4-2-3-5-21(19)25-14)13-32-18-8-6-15(7-9-18)23(29)26-22-12-17(28)11-20(22)24(30)27-31/h2-10,17,20,22,28,31H,11-13H2,1H3,(H,26,29)(H,27,30)/t17-,20-,22+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Binding affinity to MMP9				Bioorg Med Chem Lett 18: 694-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.059 BindingDB Entry DOI: 10.7270/Q2BV7HGG
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50371352 (CHEMBL438528) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2C(=O)NO)c2ccccc2n1 Show InChI InChI=1S/C24H25N3O5/c1-14-10-16(19-4-2-3-5-21(19)25-14)13-32-18-8-6-15(7-9-18)23(29)26-22-12-17(28)11-20(22)24(30)27-31/h2-10,17,20,22,28,31H,11-13H2,1H3,(H,26,29)(H,27,30)/t17-,20-,22+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Binding affinity to MMP2				Bioorg Med Chem Lett 18: 694-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.059 BindingDB Entry DOI: 10.7270/Q2BV7HGG
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50371352 (CHEMBL438528) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2C(=O)NO)c2ccccc2n1 Show InChI InChI=1S/C24H25N3O5/c1-14-10-16(19-4-2-3-5-21(19)25-14)13-32-18-8-6-15(7-9-18)23(29)26-22-12-17(28)11-20(22)24(30)27-31/h2-10,17,20,22,28,31H,11-13H2,1H3,(H,26,29)(H,27,30)/t17-,20-,22+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Binding affinity to MMP1				Bioorg Med Chem Lett 18: 694-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.059 BindingDB Entry DOI: 10.7270/Q2BV7HGG
					More data for this Ligand-Target Pair
ADAM17 (Sus scrofa (pig))	BDBM50371352 (CHEMBL438528) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)N[C@@H]2C[C@@H](O)C[C@@H]2C(=O)NO)c2ccccc2n1 Show InChI InChI=1S/C24H25N3O5/c1-14-10-16(19-4-2-3-5-21(19)25-14)13-32-18-8-6-15(7-9-18)23(29)26-22-12-17(28)11-20(22)24(30)27-31/h2-10,17,20,22,28,31H,11-13H2,1H3,(H,26,29)(H,27,30)/t17-,20-,22+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of pig TACE				Bioorg Med Chem Lett 18: 694-9 (2008) Article DOI: 10.1016/j.bmcl.2007.11.059 BindingDB Entry DOI: 10.7270/Q2BV7HGG
					More data for this Ligand-Target Pair