BDBM50127476 CHEMBL54021::N-Hydroxy-2-(7-methoxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*6*-benzo[f][1,2,5]thiadiazepin-2-yl)-propionamide

SMILES: COc1ccc2c(NCCN([C@H](C)C(=O)NO)S2(=O)=O)c1

InChI Key: InChIKey=WBMFTZHBDMFDSO-MRVPVSSYSA-N

Data: 4 KI

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 = 50127476   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50127476 (CHEMBL54021 | N-Hydroxy-2-(7-methoxy-1,1-dioxo-1,3...) Show SMILES COc1ccc2c(NCCN([C@H](C)C(=O)NO)S2(=O)=O)c1 Show InChI InChI=1S/C12H17N3O5S/c1-8(12(16)14-17)15-6-5-13-10-7-9(20-2)3-4-11(10)21(15,18)19/h3-4,7-8,13,17H,5-6H2,1-2H3,(H,14,16)/t8-/m1/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	8	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 In vitro inhibitory activity against broad spectrum matrix metalloprotease-2 (MMP-2)				J Med Chem 46: 1811-23 (2003) Article DOI: 10.1021/jm020475w BindingDB Entry DOI: 10.7270/Q2TQ60W7
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50127476 (CHEMBL54021 | N-Hydroxy-2-(7-methoxy-1,1-dioxo-1,3...) Show SMILES COc1ccc2c(NCCN([C@H](C)C(=O)NO)S2(=O)=O)c1 Show InChI InChI=1S/C12H17N3O5S/c1-8(12(16)14-17)15-6-5-13-10-7-9(20-2)3-4-11(10)21(15,18)19/h3-4,7-8,13,17H,5-6H2,1-2H3,(H,14,16)/t8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	104	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 In vitro inhibitory activity against broad spectrum matrix metalloprotease-9 (MMP-9)				J Med Chem 46: 1811-23 (2003) Article DOI: 10.1021/jm020475w BindingDB Entry DOI: 10.7270/Q2TQ60W7
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50127476 (CHEMBL54021 | N-Hydroxy-2-(7-methoxy-1,1-dioxo-1,3...) Show SMILES COc1ccc2c(NCCN([C@H](C)C(=O)NO)S2(=O)=O)c1 Show InChI InChI=1S/C12H17N3O5S/c1-8(12(16)14-17)15-6-5-13-10-7-9(20-2)3-4-11(10)21(15,18)19/h3-4,7-8,13,17H,5-6H2,1-2H3,(H,14,16)/t8-/m1/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	274	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 In vitro inhibitory activity against porcine tumor necrosis factor alpha converting enzyme (pTACE)				J Med Chem 46: 1811-23 (2003) Article DOI: 10.1021/jm020475w BindingDB Entry DOI: 10.7270/Q2TQ60W7
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50127476 (CHEMBL54021 | N-Hydroxy-2-(7-methoxy-1,1-dioxo-1,3...) Show SMILES COc1ccc2c(NCCN([C@H](C)C(=O)NO)S2(=O)=O)c1 Show InChI InChI=1S/C12H17N3O5S/c1-8(12(16)14-17)15-6-5-13-10-7-9(20-2)3-4-11(10)21(15,18)19/h3-4,7-8,13,17H,5-6H2,1-2H3,(H,14,16)/t8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.06E+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 In vitro inhibitory activity against broad spectrum matrix metalloprotease-1 (MMP-1)				J Med Chem 46: 1811-23 (2003) Article DOI: 10.1021/jm020475w BindingDB Entry DOI: 10.7270/Q2TQ60W7
					More data for this Ligand-Target Pair