BDBM50053963 (S)-3-((S)-2-{(S)-2-[3-(1-Ethyl-propyl)-ureido]-3,3-dimethyl-butyrylamino}-4-oxo-4-pyrrolidin-1-yl-butyrylamino)-N-((R)-1,2,2-trimethyl-propyl)-succinamic acid::CHEMBL131682

SMILES: CCC(CC)NC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](C)C(C)(C)C)C(C)(C)C

InChI Key: InChIKey=YVSJBLJVDLTVFG-KDNSLJGTSA-N

Data: 1 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 1 hit for monomerid = 50053963   

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
RRM1/RRM2 holoenzyme (Homo sapiens (Human))	BDBM50053963 ((S)-3-((S)-2-{(S)-2-[3-(1-Ethyl-propyl)-ureido]-3,...) Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@H](C)C(C)(C)C)C(C)(C)C Show InChI InChI=1S/C30H54N6O7/c1-10-19(11-2)32-28(43)35-24(30(7,8)9)27(42)34-20(16-22(37)36-14-12-13-15-36)26(41)33-21(17-23(38)39)25(40)31-18(3)29(4,5)6/h18-21,24H,10-17H2,1-9H3,(H,31,40)(H,33,41)(H,34,42)(H,38,39)(H2,32,35,43)/t18-,20+,21+,24-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Bio-M£ga/Boehringer Ingelheim Research Inc. Curated by ChEMBL					Assay Description Inhibitory effect was evaluated on Herpes simplex virus (HSV) ribonucleotide reductase (RR) enzyme.				J Med Chem 39: 4173-80 (1996) Article DOI: 10.1021/jm960324r BindingDB Entry DOI: 10.7270/Q28W3DZQ
					More data for this Ligand-Target Pair