BDBM50153687 (S)-4-{(S)-1-[(S)-2-Carboxy-1-((S)-1-carboxy-2-phenyl-ethylcarbamoyl)-ethylcarbamoyl]-2-cyclohexyl-ethylcarbamoyl}-4-{(S)-2-[2-(9H-fluoren-9-ylmethoxycarbonyl)-2-phenyl-acetylamino]-4-methyl-pentanoylamino}-butyric acid::CHEMBL275928

SMILES: CC(C)C[C@H](NC(=O)C(C(=O)OCC1c2ccccc2-c2ccccc12)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=HKOLZNBMCRAYAH-YFJIXWHQSA-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 = 50153687   

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
Ribonucleoside-diphosphate reductase large subunit/subunit M2 (Homo sapiens (Human))	BDBM50153687 ((S)-4-{(S)-1-[(S)-2-Carboxy-1-((S)-1-carboxy-2-phe...) Show SMILES CC(C)C[C@H](NC(=O)C(C(=O)OCC1c2ccccc2-c2ccccc12)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C56H65N5O13/c1-33(2)28-43(60-54(70)49(36-20-10-5-11-21-36)56(73)74-32-41-39-24-14-12-22-37(39)38-23-13-15-25-40(38)41)51(67)57-42(26-27-47(62)63)50(66)58-44(29-34-16-6-3-7-17-34)52(68)59-45(31-48(64)65)53(69)61-46(55(71)72)30-35-18-8-4-9-19-35/h4-5,8-15,18-25,33-34,41-46,49H,3,6-7,16-17,26-32H2,1-2H3,(H,57,67)(H,58,66)(H,59,68)(H,60,70)(H,61,69)(H,62,63)(H,64,65)(H,71,72)/t42-,43-,44-,45-,46-,49?/m0/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	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Inhibition of mammalian ribonucleotide reductase in a standard dTTP-dependent GDP reductase assay				Bioorg Med Chem Lett 14: 5301-4 (2004) Article DOI: 10.1016/j.bmcl.2004.08.028 BindingDB Entry DOI: 10.7270/Q25Q4VJF
					More data for this Ligand-Target Pair