BDBM50101721 CHEMBL293019::Cyclohexyl-((S)-4'-methoxy-biphenyl-4-sulfonylamino)-acetic acid

SMILES: COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O

InChI Key: InChIKey=NPZDPBHMFYXBRP-HXUWFJFHSA-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 = 50101721   

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
Collagenase 3 (Homo sapiens (Human))	BDBM50101721 (CHEMBL293019 | Cyclohexyl-((S)-4'-methoxy-biphenyl...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O Show InChI InChI=1S/C21H25NO5S/c1-27-18-11-7-15(8-12-18)16-9-13-19(14-10-16)28(25,26)22-20(21(23)24)17-5-3-2-4-6-17/h7-14,17,20,22H,2-6H2,1H3,(H,23,24)/t20-/m1/s1	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	43	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
Matrix metalloproteinase-7 (MMP7) (Homo sapiens (Human))	BDBM50101721 (CHEMBL293019 | Cyclohexyl-((S)-4'-methoxy-biphenyl...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O Show InChI InChI=1S/C21H25NO5S/c1-27-18-11-7-15(8-12-18)16-9-13-19(14-10-16)28(25,26)22-20(21(23)24)17-5-3-2-4-6-17/h7-14,17,20,22H,2-6H2,1H3,(H,23,24)/t20-/m1/s1	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	1.51E+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
Stromelysin-1 (Homo sapiens (Human))	BDBM50101721 (CHEMBL293019 | Cyclohexyl-((S)-4'-methoxy-biphenyl...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O Show InChI InChI=1S/C21H25NO5S/c1-27-18-11-7-15(8-12-18)16-9-13-19(14-10-16)28(25,26)22-20(21(23)24)17-5-3-2-4-6-17/h7-14,17,20,22H,2-6H2,1H3,(H,23,24)/t20-/m1/s1	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	2.15E+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-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))	BDBM50101721 (CHEMBL293019 | Cyclohexyl-((S)-4'-methoxy-biphenyl...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O Show InChI InChI=1S/C21H25NO5S/c1-27-18-11-7-15(8-12-18)16-9-13-19(14-10-16)28(25,26)22-20(21(23)24)17-5-3-2-4-6-17/h7-14,17,20,22H,2-6H2,1H3,(H,23,24)/t20-/m1/s1	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	8	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))	BDBM50101721 (CHEMBL293019 | Cyclohexyl-((S)-4'-methoxy-biphenyl...) Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N[C@H](C1CCCCC1)C(O)=O Show InChI InChI=1S/C21H25NO5S/c1-27-18-11-7-15(8-12-18)16-9-13-19(14-10-16)28(25,26)22-20(21(23)24)17-5-3-2-4-6-17/h7-14,17,20,22H,2-6H2,1H3,(H,23,24)/t20-/m1/s1	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	4.35E+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