BDBM50101497 2-[3-(4-Chloro-phenyl)-propyl]-N*1*-{2-cyclohexyl-1-[2-(4-dimethylamino-butylcarbamoyl)-ethylcarbamoyl]-ethyl}-N*4*-hydroxy-succinamide::CHEMBL77659

SMILES: CN(C)CCCCNC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccc(Cl)cc1)CC(=O)NO

InChI Key: InChIKey=QCHJWCBHICZTTP-VPUSJEBWSA-N

Data: 3 KI

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 = 50101497   

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))	BDBM50101497 (2-[3-(4-Chloro-phenyl)-propyl]-N*1*-{2-cyclohexyl-...) Show SMILES CN(C)CCCCNC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccc(Cl)cc1)CC(=O)NO Show InChI InChI=1S/C31H50ClN5O5/c1-37(2)20-7-6-18-33-28(38)17-19-34-31(41)27(21-24-9-4-3-5-10-24)35-30(40)25(22-29(39)36-42)12-8-11-23-13-15-26(32)16-14-23/h13-16,24-25,27,42H,3-12,17-22H2,1-2H3,(H,33,38)(H,34,41)(H,35,40)(H,36,39)/t25-,27+/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	0.0500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Royal Danish School of Pharmacy Curated by ChEMBL					Assay Description Inhibitory constant against matrix metalloproteinase-2				J Med Chem 44: 2333-43 (2001) BindingDB Entry DOI: 10.7270/Q2JH3KFR
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50101497 (2-[3-(4-Chloro-phenyl)-propyl]-N*1*-{2-cyclohexyl-...) Show SMILES CN(C)CCCCNC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccc(Cl)cc1)CC(=O)NO Show InChI InChI=1S/C31H50ClN5O5/c1-37(2)20-7-6-18-33-28(38)17-19-34-31(41)27(21-24-9-4-3-5-10-24)35-30(40)25(22-29(39)36-42)12-8-11-23-13-15-26(32)16-14-23/h13-16,24-25,27,42H,3-12,17-22H2,1-2H3,(H,33,38)(H,34,41)(H,35,40)(H,36,39)/t25-,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	22.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Royal Danish School of Pharmacy Curated by ChEMBL					Assay Description Inhibitory constant against matrix metalloproteinase-3				J Med Chem 44: 2333-43 (2001) BindingDB Entry DOI: 10.7270/Q2JH3KFR
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50101497 (2-[3-(4-Chloro-phenyl)-propyl]-N*1*-{2-cyclohexyl-...) Show SMILES CN(C)CCCCNC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccc(Cl)cc1)CC(=O)NO Show InChI InChI=1S/C31H50ClN5O5/c1-37(2)20-7-6-18-33-28(38)17-19-34-31(41)27(21-24-9-4-3-5-10-24)35-30(40)25(22-29(39)36-42)12-8-11-23-13-15-26(32)16-14-23/h13-16,24-25,27,42H,3-12,17-22H2,1-2H3,(H,33,38)(H,34,41)(H,35,40)(H,36,39)/t25-,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.05E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The Royal Danish School of Pharmacy Curated by ChEMBL					Assay Description Inhibitory constant against matrix metalloproteinase-1				J Med Chem 44: 2333-43 (2001) BindingDB Entry DOI: 10.7270/Q2JH3KFR
					More data for this Ligand-Target Pair