BDBM50127478 2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*6*-benzo[f][1,2,5]thiadiazepin-2-yl)-4-methyl-pentanoic acid hydroxyamide::CHEMBL301157

SMILES: CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO

InChI Key: InChIKey=KJGJYHSHMUFLOA-GFCCVEGCSA-N

Data: 4 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 5 hits for monomerid = 50127478   

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))	BDBM50127478 (2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*...) Show SMILES CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO Show InChI InChI=1S/C14H21N3O5S/c1-9(2)7-12(14(19)16-20)17-6-5-15-11-8-10(18)3-4-13(11)23(17,21)22/h3-4,8-9,12,15,18,20H,5-7H2,1-2H3,(H,16,19)/t12-/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	11	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))	BDBM50127478 (2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*...) Show SMILES CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO Show InChI InChI=1S/C14H21N3O5S/c1-9(2)7-12(14(19)16-20)17-6-5-15-11-8-10(18)3-4-13(11)23(17,21)22/h3-4,8-9,12,15,18,20H,5-7H2,1-2H3,(H,16,19)/t12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	80	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))	BDBM50127478 (2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*...) Show SMILES CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO Show InChI InChI=1S/C14H21N3O5S/c1-9(2)7-12(14(19)16-20)17-6-5-15-11-8-10(18)3-4-13(11)23(17,21)22/h3-4,8-9,12,15,18,20H,5-7H2,1-2H3,(H,16,19)/t12-/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	89	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))	BDBM50127478 (2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*...) Show SMILES CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO Show InChI InChI=1S/C14H21N3O5S/c1-9(2)7-12(14(19)16-20)17-6-5-15-11-8-10(18)3-4-13(11)23(17,21)22/h3-4,8-9,12,15,18,20H,5-7H2,1-2H3,(H,16,19)/t12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	497	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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50127478 (2-(7-Hydroxy-1,1-dioxo-1,3,4,5-tetrahydro-1lambda*...) Show SMILES CC(C)C[C@@H](N1CCNc2cc(O)ccc2S1(=O)=O)C(=O)NO Show InChI InChI=1S/C14H21N3O5S/c1-9(2)7-12(14(19)16-20)17-6-5-15-11-8-10(18)3-4-13(11)23(17,21)22/h3-4,8-9,12,15,18,20H,5-7H2,1-2H3,(H,16,19)/t12-/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	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Ability to suppress the formation of TNF-aplha in human peripheral blood mononuclear cell assay(PBMC)				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