Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'H2-K region expressed gene 2, rat orthologue' and Ligand = 'BDBM50079853'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
H2-K region expressed gene 2, rat orthologue (Rattus norvegicus)	BDBM50079853 ((S)-2-[(R)-3-(3-Cyclohexyl-propylamino)-2-oxo-pyrr...) Show SMILES CCCCN(CCCC)NC(=O)[C@H](CCC)N1CC[C@@H](NCCCC2CCCCC2)C1=O Show InChI InChI=1S/C26H50N4O2/c1-4-7-19-29(20-8-5-2)28-25(31)24(13-6-3)30-21-17-23(26(30)32)27-18-12-16-22-14-10-9-11-15-22/h22-24,27H,4-21H2,1-3H3,(H,28,31)/t23-,24+/m1/s1	PDB Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Ability to inhibit binding of biotinylated rat myelin basic protein 13-mer peptide (RMBP 90-102, Major histocompatibility complex class II to purifie...				Bioorg Med Chem Lett 9: 2115-8 (1999) BindingDB Entry DOI: 10.7270/Q2J67G3F
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