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TargetNuclear receptor ROR-gamma
LigandBDBM341804
Substrate/Competitorn/a
Meas. Tech.SPA Binding Assay
IC50 11.0±n/a nM
Citation Duan, JDhar, TGJiang, BLu, ZKarmakar, AGupta, AKWeigelt, CA Carbocyclic sulfone RORγ modulators US Patent US9771320 Publication Date 9/26/2017
More Info.:Get all data from this article,  Assay Method
 
Nuclear receptor ROR-gamma
Name:Nuclear receptor ROR-gamma
Synonyms:NR1F3 | Nuclear receptor subfamily 1 group F member 3 | RAR-related orphan receptor C (RORc) | RORC | RORG | RZRG | Retinoid-related orphan receptor-gamma | Retinoid-related orphan receptor-gamma (RORc)
Type:Protein
Mol. Mass.:58218.40
Organism:Homo sapiens (Human)
Description:P51449
Residue:518
Sequence:
MDRAPQRQHRASRELLAAKKTHTSQIEVIPCKICGDKSSGIHYGVITCEGCKGFFRRSQR
CNAAYSCTRQQNCPIDRTSRNRCQHCRLQKCLALGMSRDAVKFGRMSKKQRDSLHAEVQK
QLQQRQQQQQEPVVKTPPAGAQGADTLTYTLGLPDGQLPLGSSPDLPEASACPPGLLKAS
GSGPSYSNNLAKAGLNGASCHLEYSPERGKAEGRESFYSTGSQLTPDRCGLRFEEHRHPG
LGELGQGPDSYGSPSFRSTPEAPYASLTEIEHLVQSVCKSYRETCQLRLEDLLRQRSNIF
SREEVTGYQRKSMWEMWERCAHHLTEAIQYVVEFAKRLSGFMELCQNDQIVLLKAGAMEV
VLVRMCRAYNADNRTVFFEGKYGGMELFRALGCSELISSIFDFSHSLSALHFSEDEIALY
TALVLINAHRPGLQEKRKVEQLQYNLELAFHHHLCKTHRQSILAKLPPKGKLRSLCSQHV
ERLQIFQHLHPIVVQAAFPPLYKELFSTETESPVGLSK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM341804
NameBDBM341804
Synonyms:(3-(4-(2-((2,6-difluorobenzyl)oxy)-1,1,1,3,3,3-hexafluoropropan-2-yl)phenyl)-3-((4-fluorophenyl)sulfonyl)cyclobutyl)methanol | US9771320, Example 41
TypeSmall organic molecule
Emp. Form.C27H21F9O4S
Mol. Mass.612.504
SMILESOCC1CC(C1)(c1ccc(cc1)C(OCc1c(F)cccc1F)(C(F)(F)F)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1 |(-3.89,-8.36,;-2.55,-7.59,;-2.55,-6.05,;-1.46,-4.96,;-2.55,-3.87,;-3.64,-4.96,;-1.46,-2.78,;.02,-3.18,;1.11,-2.09,;.71,-.6,;-.77,-.21,;-1.86,-1.3,;1.8,.48,;2.89,1.57,;2.49,3.06,;3.58,4.15,;3.18,5.64,;1.7,6.04,;4.27,6.73,;5.76,6.33,;6.16,4.84,;5.07,3.75,;5.47,2.26,;.71,1.57,;-.37,2.66,;-.37,.48,;1.8,2.66,;2.89,-.6,;3.98,-1.69,;1.8,-1.69,;3.98,.48,;-3.64,-2.78,;-2.55,-1.69,;-4.73,-3.87,;-4.73,-1.69,;-6.22,-2.09,;-7.31,-1,;-6.91,.48,;-8,1.57,;-5.42,.88,;-4.33,-.21,)|
Structure
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