Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'GTPase KRas [1-37]' and Ligand = 'BDBM54667'   

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 [1-37] (Homo sapiens (Human))	BDBM54667 (4-[3-(4-methoxyphenyl)-5-[2-(trifluoromethyl)pheny...) Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccccc1C(F)(F)F |c:11| Show InChI InChI=1S/C23H20F3N3O3S/c1-32-17-10-6-15(7-11-17)22-14-21(19-4-2-3-5-20(19)23(24,25)26)28-29(22)16-8-12-18(13-9-16)33(27,30)31/h2-13,22H,14H2,1H3,(H2,27,30,31)	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q22N50Q3
					More data for this Ligand-Target Pair
GTPase KRas [1-37] (Homo sapiens (Human))	BDBM54667 (4-[3-(4-methoxyphenyl)-5-[2-(trifluoromethyl)pheny...) Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccccc1C(F)(F)F |c:11| Show InChI InChI=1S/C23H20F3N3O3S/c1-32-17-10-6-15(7-11-17)22-14-21(19-4-2-3-5-20(19)23(24,25)26)28-29(22)16-8-12-18(13-9-16)33(27,30)31/h2-13,22H,14H2,1H3,(H2,27,30,31)	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2KK9971
					More data for this Ligand-Target Pair