BAY-850

Himiki ady:

N - ((R) -1 - (((1s, 4S) -4-aminosikloheksil) aminok) -3- (4-sianofenil) propan-2 ýyl) -2-hloro-4-metoksi-5- (5 - ((((R) -1- (p-tolyl) etil) amin) metil) furan-2 ýyl) benzamid

SMILES kody:

ClC (C (C (N [C @ H]) (CC1 = CC = C (C # N) C = C1) CN [C @@ H] 2CC [C @ H] (N) CC2) = O) = C3 ) = CC (OC) = C3C (O4) = CC = C4CN [C @ H] (C) C5 = CC = C (C) C = C5

InChi kody:

InChI = 1S / C38H44ClN5O3 / c1-24-4-10-28 (11-5-24) 25 (2) 42-23-32-16-17-36 (47-32) 34-19-33 (35 ( 39) 20-37 (34) 46-3) 38 (45) 44-31 (18-26-6-8-27 (21-4) 0) 9-7-26) 22-43-30-14-12-29 (41) 13-15-30 / h4-11,16-17,19-20,25,29-31,42-43H, 12-15,18,22-23,41H2,1-3H3, (H, 44,45) / t25-, 29-, 30 +, 31- / m1 / s1

InChi açary:

BSISGUIVBKDTQO-QIKYYPRYSA-N

Açar söz:

BAY-850; BAY850; BAY 850

Çözüw:DMSO

Saklama: 

Düşündiriş:

"BAY-850, ICAD bahasy 20 nM (HTRF) bolan ATAD2 bromodomainden asetilleşdirilen H4 peptidini ýerleşdirýän ATAD2A bromodomain üçin himiki gözlegdir. MST we BROMOscan ölçegleri degişlilikde 84,9 nM we 120 nM Kd görkezýär. BAY- 850 beýleki bromodomainleriň üstünden ajaýyp saýlamany görkezýär (BROMOscan-da 10 µM-de hit ýok) we FRAP tarapyndan kesgitlenen 1 µM konsentrasiýasynda janly öýjüklerdäki doly uzynlykdaky ATAD2-ni ýerleşdirýär (http://www.thesgc.org/chemical) -probes / BAY-850) "

Maksat: ATAD2A bromodomain üçin himiki gözleg