BindingDB PrimarySearch

BDBM50129986 (4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-dimethyl-1-methylcarbamoyl-propylcarbamoyl)-butyl]-phosphinic acid::2-(((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)carbamoyl)-4-(4-chlorophenyl)butyl(4-benzylbenzyl)phosphinic acid::CHEMBL77163

SMILES: CNC(=O)[C@@H](NC(=O)C(CCc1ccc(Cl)cc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C

InChI Key: InChIKey=VAQVSMUJBPTVIS-ZBAATNBSSA-N

Data: 7 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50129986
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Neutrophil collagenase (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.560	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of matrix metalloprotease-8				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of matrix metalloprotease-2				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12) (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of matrix metalloprotease-12				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair
Matrix metalloproteinase-12 (MMP12) (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Pomona College Curated by ChEMBL					Assay Description Inhibition of MMP12				Bioorg Med Chem 15: 2223-68 (2007) Article DOI: 10.1016/j.bmc.2007.01.011 BindingDB Entry DOI: 10.7270/Q2571DBD
Pomona College Curated by ChEMBL					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibitory activity against matrix metalloprotease-1				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of matrix metalloprotease-3				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50129986 ((4-Benzyl-benzyl)-[4-(4-chloro-phenyl)-2-((S)-2,2-...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibitory activity against matrix metalloprotease-13				Bioorg Med Chem Lett 13: 2331-6 (2003) BindingDB Entry DOI: 10.7270/Q2571CJP
Pfizer Inc. Curated by ChEMBL					More data for this Ligand-Target Pair