BDBM50153689 (S)-N-{(S)-1-[(S)-2-Carboxy-1-((S)-1-carboxy-2-phenyl-ethylcarbamoyl)-ethylcarbamoyl]-2-cyclohexyl-ethyl}-3-((S)-2-{2-[(9H-fluoren-9-ylmethoxycarbonyl)-methyl-amino]-2-phenyl-acetylamino}-4-methyl-pentanoylamino)-succinamic acid::CHEMBL269498

SMILES: CC(C)C[C@H](NC(=O)C(N(C)C(=O)OCC1c2ccccc2-c2ccccc12)c1ccccc1)C(=O)N[C@@H](CC(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=YWAZZZXRMYNTOJ-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 = 50153689   

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))	BDBM50153689 ((S)-N-{(S)-1-[(S)-2-Carboxy-1-((S)-1-carboxy-2-phe...) Show SMILES CC(C)C[C@H](NC(=O)C(N(C)C(=O)OCC1c2ccccc2-c2ccccc12)c1ccccc1)C(=O)N[C@@H](CC(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/C56H66N6O13/c1-33(2)27-42(60-54(71)49(36-21-11-6-12-22-36)62(3)56(74)75-32-41-39-25-15-13-23-37(39)38-24-14-16-26-40(38)41)50(67)58-44(30-47(63)64)52(69)57-43(28-34-17-7-4-8-18-34)51(68)59-45(31-48(65)66)53(70)61-46(55(72)73)29-35-19-9-5-10-20-35/h5-6,9-16,19-26,33-34,41-46,49H,4,7-8,17-18,27-32H2,1-3H3,(H,57,69)(H,58,67)(H,59,68)(H,60,71)(H,61,70)(H,63,64)(H,65,66)(H,72,73)/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	1.90E+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