null

SMILES: CNC(=O)[C@@H]1CCCN(CC(C)CO[C@@H]([C@@H](CCCc2ccccc2)C(=O)N1)C(=O)NO)C(C)=O

InChI Key: InChIKey=JYPUUSQERHUIDJ-USQNYJEOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50077792   

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
Neutrophil collagenase (Homo sapiens (Human))	BDBM50077792 ((2S,3R,6S)-10-Acetyl-12-methyl-4-oxo-3-(3-phenyl-p...) Show SMILES CNC(=O)[C@@H]1CCCN(CC(C)CO[C@@H]([C@@H](CCCc2ccccc2)C(=O)N1)C(=O)NO)C(C)=O Show InChI InChI=1S/C25H38N4O6/c1-17-15-29(18(2)30)14-8-13-21(24(32)26-3)27-23(31)20(22(35-16-17)25(33)28-34)12-7-11-19-9-5-4-6-10-19/h4-6,9-10,17,20-22,34H,7-8,11-16H2,1-3H3,(H,26,32)(H,27,31)(H,28,33)/t17?,20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-8(MMP-8)				Bioorg Med Chem Lett 9: 1453-8 (1999) BindingDB Entry DOI: 10.7270/Q2GQ6WZS
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50077792 ((2S,3R,6S)-10-Acetyl-12-methyl-4-oxo-3-(3-phenyl-p...) Show SMILES CNC(=O)[C@@H]1CCCN(CC(C)CO[C@@H]([C@@H](CCCc2ccccc2)C(=O)N1)C(=O)NO)C(C)=O Show InChI InChI=1S/C25H38N4O6/c1-17-15-29(18(2)30)14-8-13-21(24(32)26-3)27-23(31)20(22(35-16-17)25(33)28-34)12-7-11-19-9-5-4-6-10-19/h4-6,9-10,17,20-22,34H,7-8,11-16H2,1-3H3,(H,26,32)(H,27,31)(H,28,33)/t17?,20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-9(MMP-9)				Bioorg Med Chem Lett 9: 1453-8 (1999) BindingDB Entry DOI: 10.7270/Q2GQ6WZS
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50077792 ((2S,3R,6S)-10-Acetyl-12-methyl-4-oxo-3-(3-phenyl-p...) Show SMILES CNC(=O)[C@@H]1CCCN(CC(C)CO[C@@H]([C@@H](CCCc2ccccc2)C(=O)N1)C(=O)NO)C(C)=O Show InChI InChI=1S/C25H38N4O6/c1-17-15-29(18(2)30)14-8-13-21(24(32)26-3)27-23(31)20(22(35-16-17)25(33)28-34)12-7-11-19-9-5-4-6-10-19/h4-6,9-10,17,20-22,34H,7-8,11-16H2,1-3H3,(H,26,32)(H,27,31)(H,28,33)/t17?,20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	267	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-3(MMP-3)				Bioorg Med Chem Lett 9: 1453-8 (1999) BindingDB Entry DOI: 10.7270/Q2GQ6WZS
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50077792 ((2S,3R,6S)-10-Acetyl-12-methyl-4-oxo-3-(3-phenyl-p...) Show SMILES CNC(=O)[C@@H]1CCCN(CC(C)CO[C@@H]([C@@H](CCCc2ccccc2)C(=O)N1)C(=O)NO)C(C)=O Show InChI InChI=1S/C25H38N4O6/c1-17-15-29(18(2)30)14-8-13-21(24(32)26-3)27-23(31)20(22(35-16-17)25(33)28-34)12-7-11-19-9-5-4-6-10-19/h4-6,9-10,17,20-22,34H,7-8,11-16H2,1-3H3,(H,26,32)(H,27,31)(H,28,33)/t17?,20-,21+,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-1(MMP-1)				Bioorg Med Chem Lett 9: 1453-8 (1999) BindingDB Entry DOI: 10.7270/Q2GQ6WZS
					More data for this Ligand-Target Pair