BDBM50368762 CHEMBL2369634

SMILES: C[C@@H](O)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O

InChI Key: InChIKey=ORIRKOLDQJKUJO-HYNNOYFOSA-N

Data: 2 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 2 hits for monomerid = 50368762   

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 M1 chain (Mus musculus)	BDBM50368762 (CHEMBL2369634) Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C37H47N7O14/c1-19(45)31(39-20(2)46)36(56)43-24(15-21-9-5-3-6-10-21)33(53)41-25(17-28(38)47)34(54)40-23(13-14-29(48)49)32(52)42-26(18-30(50)51)35(55)44-27(37(57)58)16-22-11-7-4-8-12-22/h3-12,19,23-27,31,45H,13-18H2,1-2H3,(H2,38,47)(H,39,46)(H,40,54)(H,41,53)(H,42,52)(H,43,56)(H,44,55)(H,48,49)(H,50,51)(H,57,58)/t19-,23+,24+,25+,26+,27+,31+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on mammalian ribonucleotide reductase				J Med Chem 36: 3859-62 (1994) BindingDB Entry DOI: 10.7270/Q2V40VTV
					More data for this Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain (Mus musculus)	BDBM50368762 (CHEMBL2369634) Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C37H47N7O14/c1-19(45)31(39-20(2)46)36(56)43-24(15-21-9-5-3-6-10-21)33(53)41-25(17-28(38)47)34(54)40-23(13-14-29(48)49)32(52)42-26(18-30(50)51)35(55)44-27(37(57)58)16-22-11-7-4-8-12-22/h3-12,19,23-27,31,45H,13-18H2,1-2H3,(H2,38,47)(H,39,46)(H,40,54)(H,41,53)(H,42,52)(H,43,56)(H,44,55)(H,48,49)(H,50,51)(H,57,58)/t19-,23+,24+,25+,26+,27+,31+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Pennsylvania Curated by ChEMBL					Assay Description Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on mammalian ribonucleotide reductase				J Med Chem 36: 3859-62 (1994) BindingDB Entry DOI: 10.7270/Q2V40VTV
					More data for this Ligand-Target Pair