BDBM285775 US10080744, Example 3/42

SMILES: CC(C)(Cc1nnc(o1)-c1nc(Cc2ccc(F)cc2)c(s1)-c1ccc(cc1C(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(O)=O

InChI Key: InChIKey=ZMJKGQFQZCQLCM-UHFFFAOYSA-N

Data: 1 IC50  1 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 285775   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Nuclear receptor ROR-gamma (RORC) (Homo sapiens (Human))	BDBM285775 (US10080744, Example 3/42) Show SMILES CC(C)(Cc1nnc(o1)-c1nc(Cc2ccc(F)cc2)c(s1)-c1ccc(cc1C(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(O)=O Show InChI InChI=1S/C27H20F9N3O4S/c1-24(2,23(40)41)11-18-38-39-21(43-18)22-37-17(9-12-3-6-14(28)7-4-12)19(44-22)15-8-5-13(10-16(15)20(29)30)25(42,26(31,32)33)27(34,35)36/h3-8,10,20,42H,9,11H2,1-2H3,(H,40,41)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description Cells used in this assay were transiently co-transfected with three different plasmids, one expressing the GAL4-DNA binding domain (DBD)-RORγt f...				US Patent US10080744 (2018) BindingDB Entry DOI: 10.7270/Q21J9CVM
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC) (Homo sapiens (Human))	BDBM285775 (US10080744, Example 3/42) Show SMILES CC(C)(Cc1nnc(o1)-c1nc(Cc2ccc(F)cc2)c(s1)-c1ccc(cc1C(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(O)=O Show InChI InChI=1S/C27H20F9N3O4S/c1-24(2,23(40)41)11-18-38-39-21(43-18)22-37-17(9-12-3-6-14(28)7-4-12)19(44-22)15-8-5-13(10-16(15)20(29)30)25(42,26(31,32)33)27(34,35)36/h3-8,10,20,42H,9,11H2,1-2H3,(H,40,41)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	0.120	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description For the RORγt construct used in the ThermoFluor assay, numbering for the nucleotide sequences was based on the reference sequence for human ROR&...				US Patent US10080744 (2018) BindingDB Entry DOI: 10.7270/Q21J9CVM
					More data for this Ligand-Target Pair