BindingDB logo
myBDB logout

BDBM50165113 CHEMBL3797671

SMILES: Cc1ccc(cc1)N(CC(=O)Nc1ccc(cc1)C#N)S(=O)(=O)Cc1ccc(F)cc1

InChI Key: InChIKey=ZIOFMOWAXVRBME-UHFFFAOYSA-N

Data: 2 IC50

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 = 50165113   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM50165113
PNG
(CHEMBL3797671)
Show SMILES Cc1ccc(cc1)N(CC(=O)Nc1ccc(cc1)C#N)S(=O)(=O)Cc1ccc(F)cc1
Show InChI InChI=1S/C23H20FN3O3S/c1-17-2-12-22(13-3-17)27(31(29,30)16-19-4-8-20(24)9-5-19)15-23(28)26-21-10-6-18(14-25)7-11-21/h2-13H,15-16H2,1H3,(H,26,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.78E+3n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Inhibition of Gal4-RORgamma-LBD (180 to 507 residues) (unknown origin) expressed in HEK293T cells after 24 hrs by dual-luciferase reporter assay


Eur J Med Chem 116: 13-26 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4SVK
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM50165113
PNG
(CHEMBL3797671)
Show SMILES Cc1ccc(cc1)N(CC(=O)Nc1ccc(cc1)C#N)S(=O)(=O)Cc1ccc(F)cc1
Show InChI InChI=1S/C23H20FN3O3S/c1-17-2-12-22(13-3-17)27(31(29,30)16-19-4-8-20(24)9-5-19)15-23(28)26-21-10-6-18(14-25)7-11-21/h2-13H,15-16H2,1H3,(H,26,28)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.58E+4n/an/an/an/an/an/a



Jilin University

Curated by ChEMBL


Assay Description
Displacement of N-terminal biotinylated SRC1-4 coactivator peptide from N-terminal His6-fused human RORgamma-LBD (262 to 507 residues) expressed in E...


Eur J Med Chem 116: 13-26 (2016)


BindingDB Entry DOI: 10.7270/Q2TT4SVK
More data for this
Ligand-Target Pair