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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'ALK tyrosine kinase receptor (G1269S)' and Ligand = 'BDBM261686'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ALK tyrosine kinase receptor (G1269S)


(Homo sapiens (Human))
BDBM261686
PNG
(US9708295, 27)
Show SMILES COc1cc(ncc1-c1cnc(N)c(O[C@H](C)c2c(Cl)ccc(F)c2Cl)c1)N1CCNC[C@@H]1C
Show InChI InChI=1S/C24H26Cl2FN5O2/c1-13-10-29-6-7-32(13)21-9-19(33-3)16(12-30-21)15-8-20(24(28)31-11-15)34-14(2)22-17(25)4-5-18(27)23(22)26/h4-5,8-9,11-14,29H,6-7,10H2,1-3H3,(H2,28,31)/t13-,14+/m0/s1
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
61.3n/an/an/an/an/an/an/an/a



Chia Tai Tianqing Pharmaceutical Group Co., Ltd

US Patent




US Patent US9708295 (2017)


BindingDB Entry DOI: 10.7270/Q2GM899Z
More data for this
Ligand-Target Pair