BDBM50343056 4-(4-(3-(cyclohexanecarboxamido)propoxy)phenylsulfonyl)-N-hydroxytetrahydro-2H-pyran-4-carboxamide::CHEMBL1770704

SMILES: ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCNC(=O)C2CCCCC2)cc1

InChI Key: InChIKey=UKBSDNIYHDAZDN-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50343056   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50343056 (4-(4-(3-(cyclohexanecarboxamido)propoxy)phenylsulf...) Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCNC(=O)C2CCCCC2)cc1 Show InChI InChI=1S/C22H32N2O7S/c25-20(17-5-2-1-3-6-17)23-13-4-14-31-18-7-9-19(10-8-18)32(28,29)22(21(26)24-27)11-15-30-16-12-22/h7-10,17,27H,1-6,11-16H2,(H,23,25)(H,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	650	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human MMP2				Bioorg Med Chem Lett 21: 2823-5 (2011) Article DOI: 10.1016/j.bmcl.2011.03.095 BindingDB Entry DOI: 10.7270/Q2CF9QD0
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50343056 (4-(4-(3-(cyclohexanecarboxamido)propoxy)phenylsulf...) Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCNC(=O)C2CCCCC2)cc1 Show InChI InChI=1S/C22H32N2O7S/c25-20(17-5-2-1-3-6-17)23-13-4-14-31-18-7-9-19(10-8-18)32(28,29)22(21(26)24-27)11-15-30-16-12-22/h7-10,17,27H,1-6,11-16H2,(H,23,25)(H,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human MMP13				Bioorg Med Chem Lett 21: 2823-5 (2011) Article DOI: 10.1016/j.bmcl.2011.03.095 BindingDB Entry DOI: 10.7270/Q2CF9QD0
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50343056 (4-(4-(3-(cyclohexanecarboxamido)propoxy)phenylsulf...) Show SMILES ONC(=O)C1(CCOCC1)S(=O)(=O)c1ccc(OCCCNC(=O)C2CCCCC2)cc1 Show InChI InChI=1S/C22H32N2O7S/c25-20(17-5-2-1-3-6-17)23-13-4-14-31-18-7-9-19(10-8-18)32(28,29)22(21(26)24-27)11-15-30-16-12-22/h7-10,17,27H,1-6,11-16H2,(H,23,25)(H,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human MMP8				Bioorg Med Chem Lett 21: 2823-5 (2011) Article DOI: 10.1016/j.bmcl.2011.03.095 BindingDB Entry DOI: 10.7270/Q2CF9QD0
					More data for this Ligand-Target Pair