BDBM50286348 (R)-N*1*-[(S)-1-[2-(2-Dimethylamino-ethylsulfanyl)-ethylcarbamoyl]-2-(1H-indol-3-yl)-ethyl]-N*4*-hydroxy-2-isobutyl-succinamide::CHEMBL116507

SMILES: CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCSCCN(C)C

InChI Key: InChIKey=NUHAFINENPHFDX-GCJKJVERSA-N

Data: 1 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 1 hit for monomerid = 50286348   

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))	BDBM50286348 ((R)-N*1*-[(S)-1-[2-(2-Dimethylamino-ethylsulfanyl)...) Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCSCCN(C)C Show InChI InChI=1S/C25H39N5O4S/c1-17(2)13-18(15-23(31)29-34)24(32)28-22(25(33)26-9-11-35-12-10-30(3)4)14-19-16-27-21-8-6-5-7-20(19)21/h5-8,16-18,22,27,34H,9-15H2,1-4H3,(H,26,33)(H,28,32)(H,29,31)/t18-,22+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for inhibitory activity against Human fidroblast collagenase (HFC)				Bioorg Med Chem Lett 5: 337-342 (1995) Article DOI: 10.1016/0960-894X(95)00031-N BindingDB Entry DOI: 10.7270/Q2P55NH1
					More data for this Ligand-Target Pair