Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene Wnt-1' and Ligand = 'BDBM385046'   

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
Proto-oncogene Wnt-1 (Homo sapiens (human))	BDBM385046 (US10287267, Compound 10 | US10508099, Compound 10 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)[C@H]3CC[C@H](CN4CC(F)C4)CC3)cc2c1 |r,wU:19.20,wD:16.16,(-10.66,3.21,;-9.89,1.88,;-8.43,1.41,;-8.43,-.13,;-9.89,-.61,;-10.8,.64,;-7.09,-.9,;-7.09,-2.44,;-5.76,-3.21,;-4.43,-2.44,;-3.09,-3.21,;-1.76,-2.44,;-1.76,-.9,;-.43,-.13,;.91,-.9,;.91,-2.44,;2.24,-.13,;3.58,-.9,;4.91,-.13,;4.91,1.41,;6.24,2.18,;7.58,1.41,;7.98,-.08,;9.46,.32,;10.8,-.45,;9.06,1.8,;3.58,2.18,;2.24,1.41,;-3.09,-.13,;-4.43,-.9,;-5.76,-.13,)| Show InChI InChI=1S/C24H28FN5O/c1-29-13-21(11-27-29)18-6-7-19-10-26-23(9-20(19)8-18)28-24(31)17-4-2-16(3-5-17)12-30-14-22(25)15-30/h6-11,13,16-17,22H,2-5,12,14-15H2,1H3,(H,26,28,31)/t16-,17-	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	277	n/a	n/a	n/a	n/a
Samumed, LLC US Patent					Assay Description SW480 colon carcinoma cells were transduced with a lentiviral vector expressing luciferase with a human Sp5 promoter consisting of a sequence of eigh...				US Patent US10508099 (2019) BindingDB Entry DOI: 10.7270/Q2DJ5J0C
					More data for this Ligand-Target Pair
Proto-oncogene Wnt-1 (Homo sapiens (human))	BDBM385046 (US10287267, Compound 10 | US10508099, Compound 10 ...) Show SMILES Cn1cc(cn1)-c1ccc2cnc(NC(=O)[C@H]3CC[C@H](CN4CC(F)C4)CC3)cc2c1 |r,wU:19.20,wD:16.16,(-10.66,3.21,;-9.89,1.88,;-8.43,1.41,;-8.43,-.13,;-9.89,-.61,;-10.8,.64,;-7.09,-.9,;-7.09,-2.44,;-5.76,-3.21,;-4.43,-2.44,;-3.09,-3.21,;-1.76,-2.44,;-1.76,-.9,;-.43,-.13,;.91,-.9,;.91,-2.44,;2.24,-.13,;3.58,-.9,;4.91,-.13,;4.91,1.41,;6.24,2.18,;7.58,1.41,;7.98,-.08,;9.46,.32,;10.8,-.45,;9.06,1.8,;3.58,2.18,;2.24,1.41,;-3.09,-.13,;-4.43,-.9,;-5.76,-.13,)| Show InChI InChI=1S/C24H28FN5O/c1-29-13-21(11-27-29)18-6-7-19-10-26-23(9-20(19)8-18)28-24(31)17-4-2-16(3-5-17)12-30-14-22(25)15-30/h6-11,13,16-17,22H,2-5,12,14-15H2,1H3,(H,26,28,31)/t16-,17-	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	277	n/a	n/a	n/a	n/a
Novartis					Assay Description The screening assay for Wnt activity is described as follows. Reporter cell lines can be generated by stably transducing cancer cell lines (e.g., col...				J Med Chem 51: 7049-52 (2008) BindingDB Entry DOI: 10.7270/Q2MS3W3C
					More data for this Ligand-Target Pair