Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,V804M]' and Ligand = 'BDBM305705'   

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 tyrosine-protein kinase receptor Ret [658-1114,V804M] (Homo sapiens (Human))	BDBM305705 (2-chloro-N-((3S,4S)-1-(5- (3-cyano-6- ethoxypyrazo...) Show SMILES CCOc1cc(-c2ccc(nc2)N2CC[C@H](NC(=O)c3c(F)cccc3Cl)[C@@H](O)C2)c2c(cnn2c1)C#N |r| Show InChI InChI=1S/C27H24ClFN6O3/c1-2-38-18-10-19(26-17(11-30)13-32-35(26)14-18)16-6-7-24(31-12-16)34-9-8-22(23(36)15-34)33-27(37)25-20(28)4-3-5-21(25)29/h3-7,10,12-14,22-23,36H,2,8-9,15H2,1H3,(H,33,37)/t22-,23-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Array Biopharma Inc. US Patent					Assay Description Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF KinEASE-TK assay techn...				US Patent US10441581 (2019) BindingDB Entry DOI: 10.7270/Q2DZ0BP3
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret [658-1114,V804M] (Homo sapiens (Human))	BDBM305705 (2-chloro-N-((3S,4S)-1-(5- (3-cyano-6- ethoxypyrazo...) Show SMILES CCOc1cc(-c2ccc(nc2)N2CC[C@H](NC(=O)c3c(F)cccc3Cl)[C@@H](O)C2)c2c(cnn2c1)C#N |r| Show InChI InChI=1S/C27H24ClFN6O3/c1-2-38-18-10-19(26-17(11-30)13-32-35(26)14-18)16-6-7-24(31-12-16)34-9-8-22(23(36)15-34)33-27(37)25-20(28)4-3-5-21(25)29/h3-7,10,12-14,22-23,36H,2,8-9,15H2,1H3,(H,33,37)/t22-,23-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Array BioPharma Inc. US Patent					Assay Description Compounds of Formula I were screened for their ability to inhibit wildtype and V804M mutant RET kinase using CisBio's HTRF® KinEASE-TK assay tech...				US Patent US10172845 (2019) BindingDB Entry DOI: 10.7270/Q2M90BR9
					More data for this Ligand-Target Pair