Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'SH2B adapter protein 2' and Ligand = 'BDBM479357'   

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
SH2B adapter protein 2 (Human)	BDBM479357 ((S)-1'-(5-(((6aS,8S)-8-((methoxy- methoxy)methyl)-...) Show SMILES COCOC[C@H]1C[C@H]2COc3c(Sc4cnc(cn4)N4CCC5(Cc6ncccc6[C@H]5N)CC4)ccnc3N2C1 |r| Show InChI InChI=1S/C29H35N7O3S/c1-37-18-38-16-19-11-20-17-39-26-23(4-8-32-28(26)36(20)15-19)40-25-14-33-24(13-34-25)35-9-5-29(6-10-35)12-22-21(27(29)30)3-2-7-31-22/h2-4,7-8,13-14,19-20,27H,5-6,9-12,15-18,30H2,1H3/t19-,20-,27+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The phosphatase reactions were carried out at room temperature in 384-well black polystyrene plates (Greiner Bio-One, Cat #784076) using assay buffer...				Citation and Details BindingDB Entry DOI: 10.7270/Q2VT1W7X
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