BDBM50431419 CHEMBL2348057

SMILES: CC(=O)N[C@@H](CC(O)=O)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3c[nH]c4ccccc34)Nc12

InChI Key: InChIKey=GCYKOCDHMOCFOC-AWCRTANDSA-N

Data: 1 Kd

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 = 50431419   

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 subunit alpha (Mycobacterium tuberculosis)	BDBM50431419 (CHEMBL2348057) Show SMILES CC(=O)N[C@@H](CC(O)=O)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3c[nH]c4ccccc34)Nc12 |r| Show InChI InChI=1S/C35H36N6O8/c1-20(42)37-27(16-31(44)45)33(46)40-26-13-7-10-22-18-41(19-30(43)38-29(35(48)49)14-21-8-3-2-4-9-21)34(47)28(39-32(22)26)15-23-17-36-25-12-6-5-11-24(23)25/h2-13,17,27-29,36,39H,14-16,18-19H2,1H3,(H,37,42)(H,38,43)(H,40,46)(H,44,45)(H,48,49)/t27-,28-,29-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	>1.50E+5	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Displacement of Dansyl-Gly-Ser-Gly-Glu-Asp-Asp-Asp-Trp-Asp-Phe from C-terminal R1 subunit of Mycobacterium tuberculosis ribonucleotide reductase by f...				Bioorg Med Chem 21: 1992-2000 (2013) Article DOI: 10.1016/j.bmc.2013.01.020 BindingDB Entry DOI: 10.7270/Q2T43VG6
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