Reaction Details Report a problem with these data
Target
Nicotinamide phosphoribosyltransferase
Ligand
BDBM50347425
Substrate
n/a
Meas. Tech.
ChEMBL_754944 (CHEMBL1805766)
IC50
25±n/a nM
Citation
 Lockman, JW; Murphy, BR; Zigar, DF; Judd, WR; Slattum, PM; Gao, ZH; Ostanin, K; Green, J; McKinnon, R; Terry-Lorenzo, RT; Fleischer, TC; Boniface, JJ; Shenderovich, M; Willardsen, JA Analogues of 4-[(7-Bromo-2-methyl-4-oxo-3H-quinazolin-6-yl)methylprop-2-ynylamino]-N-(3-pyridylmethyl)benzamide (CB-30865) as potent inhibitors of nicotinamide phosphoribosyltransferase (Nampt). J Med Chem 53:8734-46 (2010) [PubMed]  Article 
Target
Name:
Nicotinamide phosphoribosyltransferase
Synonyms:
NAMPT | NAMPT_HUMAN | NAmPRTase | Nicotinamide phosphoribosyltransferase | Nicotinamide phosphoribosyltransferase (NAMPT) | PBEF | PBEF1 | Pre-B-cell colony-enhancing factor 1
Type:
Enzyme
Mol. Mass.:
55524.98
Organism:
Homo sapiens (Human)
Description:
P43490
Residue:
491
Sequence:
MNPAAEAEFNILLATDSYKVTHYKQYPPNTSKVYSYFECREKKTENSKLRKVKYEETVFYGLQYILNKYLKGKVVTKEKIQEAKDVYKEHFQDDVFNEKGWNYILEKYDGHLPIEIKAVPEGFVIPRGNVLFTVENTDPECYWLTNWIETILVQSWYPITVATNSREQKKILAKYLLETSGNLDGLEYKLHDFGYRGVSSQETAGIGASAHLVNFKGTDTVAGLALIKKYYGTKDPVPGYSVPAAEHSTITAWGKDHEKDAFEHIVTQFSSVPVSVVSDSYDIYNACEKIWGEDLRHLIVSRSTQAPLIIRPDSGNPLDTVLKVLEILGKKFPVTENSKGYKLLPPYLRVIQGDGVDINTLQEIVEGMKQKMWSIENIAFGSGGGLLQKLTRDLLNCSFKCSYVVTNGLGINVFKDPVADPNKRSKKGRLSLHRTPAGNFVTLEEGKGDLEEYGQDLLHTVFKNGKVTKSYSFDEIRKNAQLNIELEAAHH
  
Inhibitor
Name:
BDBM50347425
Synonyms:
CHEMBL1801936
Type:
Small organic molecule
Emp. Form.:
C31H31ClN6O2
Mol. Mass.:
555.07
SMILES:
CC(C)=CCN(Cc1cc2c(cc1Cl)nc(C)n(C)c2=O)c1ccc(cc1)C(=O)NCc1nc2ccccc2[nH]1 |(1.23,-37.16,;-.11,-36.39,;-1.44,-37.17,;-.11,-34.85,;-1.45,-34.09,;-1.45,-32.55,;-2.79,-31.78,;-4.12,-32.56,;-5.45,-31.79,;-6.78,-32.56,;-6.78,-34.1,;-5.45,-34.87,;-4.12,-34.1,;-2.78,-34.87,;-8.1,-34.86,;-9.43,-34.1,;-10.77,-34.87,;-9.43,-32.56,;-10.77,-31.79,;-8.1,-31.78,;-8.1,-30.24,;-.12,-31.77,;1.21,-32.54,;2.54,-31.77,;2.54,-30.23,;1.19,-29.46,;-.14,-30.24,;3.87,-29.45,;3.86,-27.91,;5.21,-30.21,;6.54,-29.44,;7.87,-30.2,;9.28,-29.57,;10.32,-30.71,;11.85,-30.7,;12.63,-32.02,;11.87,-33.36,;10.33,-33.37,;9.55,-32.04,;8.05,-31.73,)|
Structure:
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