BDBM50153651 CHEMBL3775385

SMILES: CCC(C)CCc1nnc(CCC(=O)Nc2ccc(C)cc2C)n1C1CC1

InChI Key: InChIKey=UTGGRCANPVTWAT-UHFFFAOYSA-N

Data: 2 EC50

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 = 50153651   

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 (Mus musculus)	BDBM50153651 (CHEMBL3775385) Show SMILES CCC(C)CCc1nnc(CCC(=O)Nc2ccc(C)cc2C)n1C1CC1 Show InChI InChI=1S/C22H32N4O/c1-5-15(2)7-11-20-24-25-21(26(20)18-8-9-18)12-13-22(27)23-19-10-6-16(3)14-17(19)4/h6,10,14-15,18H,5,7-9,11-13H2,1-4H3,(H,23,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of mouse RORgamma ligand binding domain (Isoleucine 251 to Lysine 516) expressed in CHOK1 cells incubated for 2 days by Gal4 luciferase re...				ACS Med Chem Lett 7: 23-7 (2016) BindingDB Entry DOI: 10.7270/Q2N58P7P
					More data for this Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC) (Homo sapiens (Human))	BDBM50153651 (CHEMBL3775385) Show SMILES CCC(C)CCc1nnc(CCC(=O)Nc2ccc(C)cc2C)n1C1CC1 Show InChI InChI=1S/C22H32N4O/c1-5-15(2)7-11-20-24-25-21(26(20)18-8-9-18)12-13-22(27)23-19-10-6-16(3)14-17(19)4/h6,10,14-15,18H,5,7-9,11-13H2,1-4H3,(H,23,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of human RORgamma ligand binding domain (Serine 253 to Lysine 518 residues) expressed in CHOK1 cells incubated for 2 days by Gal4 lucifera...				ACS Med Chem Lett 7: 23-7 (2016) BindingDB Entry DOI: 10.7270/Q2N58P7P
					More data for this Ligand-Target Pair