Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'GTPase KRas [G12D]' and Ligand = 'BDBM485655'   

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
GTPase KRas [G12D] (Homo sapiens (Human))	BDBM485655 (US10940139, Example 02555 | US11000515, Compound T...) Show SMILES Cc1cccc(OCC(=O)Nc2nnc([nH]2)-c2ccccn2)c1 Show InChI InChI=1S/C16H15N5O2/c1-11-5-4-6-12(9-11)23-10-14(22)18-16-19-15(20-21-16)13-7-2-3-8-17-13/h2-9H,10H2,1H3,(H2,18,19,20,21,22)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shy Therapeutics LLC US Patent					Assay Description Buffer-I: 50 mM Tris, pH 7.5 150 mM NaCl (optional) 1 mM MgCl2 1 mM DTT. KRas G12D mutant protein was expressed as...				US Patent US10940139 (2021) BindingDB Entry DOI: 10.7270/Q2B27ZD1
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