BDBM50101726 CHEMBL305160::[3-(Methanesulfonyl-methyl-amino)-cyclohexyl]-(4'-methoxy-biphenyl-4-sulfonylamino)-acetic acid

SMILES: COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O

InChI Key: InChIKey=CPDXTLZUFAYJLD-UHFFFAOYSA-N

Data: 5 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 = 50101726   

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
Stromelysin-1 (Homo sapiens (Human))	BDBM50101726 (CHEMBL305160 | [3-(Methanesulfonyl-methyl-amino)-c...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C23H30N2O7S2/c1-25(33(3,28)29)19-6-4-5-18(15-19)22(23(26)27)24-34(30,31)21-13-9-17(10-14-21)16-7-11-20(32-2)12-8-16/h7-14,18-19,22,24H,4-6,15H2,1-3H3,(H,26,27)	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	560	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibitory concentration of the compound against Matrix metalloproteinase-3				Bioorg Med Chem Lett 11: 1975-9 (2001) BindingDB Entry DOI: 10.7270/Q2S181SV
					More data for this Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human))	BDBM50101726 (CHEMBL305160 | [3-(Methanesulfonyl-methyl-amino)-c...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C23H30N2O7S2/c1-25(33(3,28)29)19-6-4-5-18(15-19)22(23(26)27)24-34(30,31)21-13-9-17(10-14-21)16-7-11-20(32-2)12-8-16/h7-14,18-19,22,24H,4-6,15H2,1-3H3,(H,26,27)	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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibitory concentration of the compound against Matrix metalloproteinase-7				Bioorg Med Chem Lett 11: 1975-9 (2001) BindingDB Entry DOI: 10.7270/Q2S181SV
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50101726 (CHEMBL305160 | [3-(Methanesulfonyl-methyl-amino)-c...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C23H30N2O7S2/c1-25(33(3,28)29)19-6-4-5-18(15-19)22(23(26)27)24-34(30,31)21-13-9-17(10-14-21)16-7-11-20(32-2)12-8-16/h7-14,18-19,22,24H,4-6,15H2,1-3H3,(H,26,27)	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	29	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibitory concentration of the compound against Matrix metalloproteinase-13				Bioorg Med Chem Lett 11: 1975-9 (2001) BindingDB Entry DOI: 10.7270/Q2S181SV
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50101726 (CHEMBL305160 | [3-(Methanesulfonyl-methyl-amino)-c...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C23H30N2O7S2/c1-25(33(3,28)29)19-6-4-5-18(15-19)22(23(26)27)24-34(30,31)21-13-9-17(10-14-21)16-7-11-20(32-2)12-8-16/h7-14,18-19,22,24H,4-6,15H2,1-3H3,(H,26,27)	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	17	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibitory concentration of the compound against Matrix metalloproteinase-2				Bioorg Med Chem Lett 11: 1975-9 (2001) BindingDB Entry DOI: 10.7270/Q2S181SV
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50101726 (CHEMBL305160 | [3-(Methanesulfonyl-methyl-amino)-c...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)N(C)S(C)(=O)=O)C(O)=O Show InChI InChI=1S/C23H30N2O7S2/c1-25(33(3,28)29)19-6-4-5-18(15-19)22(23(26)27)24-34(30,31)21-13-9-17(10-14-21)16-7-11-20(32-2)12-8-16/h7-14,18-19,22,24H,4-6,15H2,1-3H3,(H,26,27)	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	4.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
Procter and Gamble Pharmaceuticals Curated by ChEMBL					Assay Description In vitro inhibitory concentration of the compound against Matrix metalloproteinase-1				Bioorg Med Chem Lett 11: 1975-9 (2001) BindingDB Entry DOI: 10.7270/Q2S181SV
					More data for this Ligand-Target Pair