Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor ROR-gamma' and Ligand = 'BDBM497658'   

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
Nuclear receptor ROR-gamma (Homo sapiens (Human))	BDBM497658 (2-[4-[6-[(1S,8R)-5-(2,6-difluorophenyl)- 11,11-dim...) Show SMILES CC1(C)[C@H]2CC[C@@]1(c1nnc(cc21)-c1c(F)cccc1F)c1cccc(n1)-c1cnn(CC(N)=O)c1 |r,THB:8:7:4.5:1,11:12:4.5:1| Show InChI InChI=1S/C27H24F2N6O/c1-26(2)17-9-10-27(26,22-8-4-7-20(32-22)15-12-31-35(13-15)14-23(30)36)25-16(17)11-21(33-34-25)24-18(28)5-3-6-19(24)29/h3-8,11-13,17H,9-10,14H2,1-2H3,(H2,30,36)/t17-,27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description 50 mM HEPES buffer (pH 7.4); 150 mM NaCl; 1 mM DTT; 5 mM MgCl2; 0.01% BSA; 5% DMSO; 0.6 ug/mL RORc receptor; 6 nM 25-[3H]hydroxycholesterol. For NSB ...				US Patent US11008312 (2021) BindingDB Entry DOI: 10.7270/Q24M97NW
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