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Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase ABL1 [131-238]' and Ligand = 'BDBM231647'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Tyrosine-protein kinase ABL1 [131-238]


(Homo sapiens (Human))		BDBM231647
PNG
(SSPIpYEDAA | pY421)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccc(OP(O)(O)=O)cc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(O)=O |r|
Show InChI InChI=1S/C41H62N9O20P/c1-5-19(2)32(49-38(62)29-7-6-14-50(29)40(64)28(18-52)48-34(58)24(42)17-51)39(63)47-26(15-22-8-10-23(11-9-22)70-71(67,68)69)37(61)45-25(12-13-30(53)54)35(59)46-27(16-31(55)56)36(60)43-20(3)33(57)44-21(4)41(65)66/h8-11,19-21,24-29,32,51-52H,5-7,12-18,42H2,1-4H3,(H,43,60)(H,44,57)(H,45,61)(H,46,59)(H,47,63)(H,48,58)(H,49,62)(H,53,54)(H,55,56)(H,65,66)(H2,67,68,69)/t19-,20-,21-,24-,25-,26-,27-,28-,29-,32-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 3.33E+3n/an/an/a7.25n/a



Yale University



Assay Description
SH2 domains were dialyzed into binding buffer (50 mM Hepes, pH 7.25, 150 mM NaCl, 0.01% Nonidet P-40, 5% glycerol) and a 30-μl volume serially d...

J Biol Chem 289: 19704-13 (2014)


Article DOI: 10.1074/jbc.M114.556480
BindingDB Entry DOI: 10.7270/Q2KW5DXT
More data for this
Ligand-Target Pair