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BDBM197816 BDBM197817::US9216988, 63

SMILES: CS(=O)(=O)NC1CCN(CC1)c1ccc(CN(CC(F)(F)F)S(=O)(=O)Cc2ccccc2)c(F)c1

InChI Key: InChIKey=YFKDUQRNZGRACA-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 = 197816   
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))
BDBM197816
PNG
(BDBM197817 | US9216988, 63)
Show SMILES CS(=O)(=O)NC1CCN(CC1)c1ccc(CN(CC(F)(F)F)S(=O)(=O)Cc2ccccc2)c(F)c1
Show InChI InChI=1S/C22H27F4N3O4S2/c1-34(30,31)27-19-9-11-28(12-10-19)20-8-7-18(21(23)13-20)14-29(16-22(24,25)26)35(32,33)15-17-5-3-2-4-6-17/h2-8,13,19,27H,9-12,14-16H2,1H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.10E+3n/an/an/an/a7.4n/a



Genentech, Inc.

US Patent


Assay Description
On day of the assay, 100 uL of 0.05% CHAPS (in deionized H2O) was added to all wells of the GFB Unifilter plate and allowed soak for 1 h. A wash bu...


US Patent US9216988 (2015)


BindingDB Entry DOI: 10.7270/Q2TB15QC
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM197816
PNG
(BDBM197817 | US9216988, 63)
Show SMILES CS(=O)(=O)NC1CCN(CC1)c1ccc(CN(CC(F)(F)F)S(=O)(=O)Cc2ccccc2)c(F)c1
Show InChI InChI=1S/C22H27F4N3O4S2/c1-34(30,31)27-19-9-11-28(12-10-19)20-8-7-18(21(23)13-20)14-29(16-22(24,25)26)35(32,33)15-17-5-3-2-4-6-17/h2-8,13,19,27H,9-12,14-16H2,1H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 20n/an/an/an/a7.4n/a



Genentech, Inc.

US Patent


Assay Description
On day of the assay, 100 uL of 0.05% CHAPS (in deionized H2O) was added to all wells of the GFB Unifilter plate and allowed soak for 1 h. A wash bu...


US Patent US9216988 (2015)


BindingDB Entry DOI: 10.7270/Q2TB15QC
More data for this
Ligand-Target Pair