Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase receptor' and Ligand = 'BDBM144301'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Tyrosine-protein kinase receptor (Homo sapiens (Human))	BDBM144301 (US8969336, 406) Show SMILES CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(C3)N(C)C)c(c2)C(F)(F)F)nc1N[C@H]1CC[C@H](O)CC1 |r,wU:31.33,wD:34.37,(3.9,1.43,;3.9,-.11,;2.57,-.88,;1.18,-.13,;-.15,-.9,;-.92,.43,;-.15,1.76,;-2.46,.43,;-.15,-2.44,;-1.48,-3.21,;-2.82,-2.44,;-2.82,-.9,;-4.15,-.13,;-5.48,-.9,;-6.82,-.13,;-8.28,-.61,;-9.19,.64,;-8.28,1.88,;-6.82,1.41,;-9.05,3.21,;-8.28,4.55,;-10.59,3.21,;-5.53,-2.47,;-4.15,-3.21,;-6.87,-3.24,;-8.2,-4.01,;-6.1,-4.58,;-7.64,-1.91,;1.18,-3.21,;2.52,-2.44,;3.85,-3.21,;5.19,-2.44,;5.19,-.9,;6.52,-.13,;7.85,-.9,;9.19,-.13,;7.85,-2.44,;6.52,-3.21,)| Show InChI InChI=1S/C26H36F3N7O2/c1-4-20-24(31-15-5-8-18(37)9-6-15)34-25(22(33-20)23(30)38)32-16-7-10-21(19(13-16)26(27,28)29)36-12-11-17(14-36)35(2)3/h7,10,13,15,17-18,37H,4-6,8-9,11-12,14H2,1-3H3,(H2,30,38)(H2,31,32,34)/t15-,17?,18-	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.340	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc.; Kotobuki Pharmaceutical Co., Ltd. US Patent					Assay Description A recombinant retrovirus was created from expression plasmid FLAG-EML4-ALKv1/pMX-iresCD8 in which cDNA for EMLA-ALK fusion protein v1 was integrated,...				US Patent US8969336 (2015) BindingDB Entry DOI: 10.7270/Q2NV9GZW
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