Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor ROR-gamma' and Ligand = 'BDBM497520'   

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))	BDBM497520 ((1S,8R)-5-(2,6-difluorophenyl)-11,11- dimethyl-1-[...) Show SMILES CC1(C)[C@H]2CC[C@@]1(c1nnc(cc21)-c1c(F)cccc1F)c1cncc(n1)-c1cnn(CCS(C)(=O)=O)c1 |r,THB:8:7:4.5:1,11:12:4.5:1| Show InChI InChI=1S/C27H26F2N6O2S/c1-26(2)18-7-8-27(26,25-17(18)11-21(33-34-25)24-19(28)5-4-6-20(24)29)23-14-30-13-22(32-23)16-12-31-35(15-16)9-10-38(3,36)37/h4-6,11-15,18H,7-10H2,1-3H3/t18-,27-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.10	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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