BDBM50101713 (3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-sulfonylamino)-acetic acid::CHEMBL303286

SMILES: COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O

InChI Key: InChIKey=ZYWQCDFNGKDOSB-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 = 50101713   

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
Interstitial collagenase (Homo sapiens (Human))	BDBM50101713 ((3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O Show InChI InChI=1S/C28H32N2O5S/c1-35-25-14-10-21(11-15-25)22-12-16-26(17-13-22)36(33,34)30-27(28(31)32)23-8-5-9-24(18-23)29-19-20-6-3-2-4-7-20/h2-4,6-7,10-17,23-24,27,29-30H,5,8-9,18-19H2,1H3,(H,31,32)	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	7.96E+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
Stromelysin-1 (Homo sapiens (Human))	BDBM50101713 ((3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O Show InChI InChI=1S/C28H32N2O5S/c1-35-25-14-10-21(11-15-25)22-12-16-26(17-13-22)36(33,34)30-27(28(31)32)23-8-5-9-24(18-23)29-19-20-6-3-2-4-7-20/h2-4,6-7,10-17,23-24,27,29-30H,5,8-9,18-19H2,1H3,(H,31,32)	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	860	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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50101713 ((3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O Show InChI InChI=1S/C28H32N2O5S/c1-35-25-14-10-21(11-15-25)22-12-16-26(17-13-22)36(33,34)30-27(28(31)32)23-8-5-9-24(18-23)29-19-20-6-3-2-4-7-20/h2-4,6-7,10-17,23-24,27,29-30H,5,8-9,18-19H2,1H3,(H,31,32)	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	15	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
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human))	BDBM50101713 ((3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O Show InChI InChI=1S/C28H32N2O5S/c1-35-25-14-10-21(11-15-25)22-12-16-26(17-13-22)36(33,34)30-27(28(31)32)23-8-5-9-24(18-23)29-19-20-6-3-2-4-7-20/h2-4,6-7,10-17,23-24,27,29-30H,5,8-9,18-19H2,1H3,(H,31,32)	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))	BDBM50101713 ((3-Benzylamino-cyclohexyl)-(4'-methoxy-biphenyl-4-...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C1CCCC(C1)NCc1ccccc1)C(O)=O Show InChI InChI=1S/C28H32N2O5S/c1-35-25-14-10-21(11-15-25)22-12-16-26(17-13-22)36(33,34)30-27(28(31)32)23-8-5-9-24(18-23)29-19-20-6-3-2-4-7-20/h2-4,6-7,10-17,23-24,27,29-30H,5,8-9,18-19H2,1H3,(H,31,32)	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	67	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