Reaction Details Report a problem with these data
Target
Nuclear receptor ROR-gamma
Ligand
BDBM475878
Substrate
n/a
Meas. Tech.
Fluorescence Resonance Energy Transfer (FRET) Assay
IC50
<500±n/a nM
Citation
 Wang, Y; Huang, Y; Yu, F; Tang, T Biaryl urea derivative or salt thereof and preparation process and use for the same US Patent  US10851050 Publication Date 12/1/2020 
Target
Name:
Nuclear receptor ROR-gamma
Synonyms:
NR1F3 | Nuclear receptor ROR-gamma | Nuclear receptor ROR-gamma (RORC) | Nuclear receptor subfamily 1 group F member 3 | RAR-related orphan receptor C (RORc) | RORC | RORG | RORG_HUMAN | RZRG | Retinoid-related orphan receptor-gamma | Retinoid-related orphan receptor-gamma (RORc)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
58218.40
Organism:
Homo sapiens (Human)
Description:
P51449
Residue:
518
Sequence:
MDRAPQRQHRASRELLAAKKTHTSQIEVIPCKICGDKSSGIHYGVITCEGCKGFFRRSQRCNAAYSCTRQQNCPIDRTSRNRCQHCRLQKCLALGMSRDAVKFGRMSKKQRDSLHAEVQKQLQQRQQQQQEPVVKTPPAGAQGADTLTYTLGLPDGQLPLGSSPDLPEASACPPGLLKASGSGPSYSNNLAKAGLNGASCHLEYSPERGKAEGRESFYSTGSQLTPDRCGLRFEEHRHPGLGELGQGPDSYGSPSFRSTPEAPYASLTEIEHLVQSVCKSYRETCQLRLEDLLRQRSNIFSREEVTGYQRKSMWEMWERCAHHLTEAIQYVVEFAKRLSGFMELCQNDQIVLLKAGAMEVVLVRMCRAYNADNRTVFFEGKYGGMELFRALGCSELISSIFDFSHSLSALHFSEDEIALYTALVLINAHRPGLQEKRKVEQLQYNLELAFHHHLCKTHRQSILAKLPPKGKLRSLCSQHVERLQIFQHLHPIVVQAAFPPLYKELFSTETESPVGLSK
  
Inhibitor
Name:
BDBM475878
Synonyms:
3-(4-((3-(2,6-dichloro-2′-(trifluoromethoxy)-[1,1′-biphenyl]-4-yl)ureido)methyl)-3-methylphenyl) acetic acid | US10851050, Example I-34
Type:
Small organic molecule
Emp. Form.:
C24H19Cl2F3N2O4
Mol. Mass.:
527.32
SMILES:
Cc1cc(CC(O)=O)ccc1CNC(=O)Nc1cc(Cl)c(c(Cl)c1)-c1ccccc1OC(F)(F)F |(3.47,-1.33,;4.24,,;5.78,,;6.55,1.33,;8.09,1.33,;8.86,2.67,;10.4,2.67,;8.09,4,;5.78,2.67,;4.24,2.67,;3.47,1.33,;1.93,1.33,;1.16,,;-.38,,;-1.16,1.33,;-1.16,-1.33,;-2.7,-1.33,;-3.47,-2.67,;-5.01,-2.67,;-5.78,-4,;-5.78,-1.33,;-5.01,,;-5.78,1.33,;-3.47,,;-7.32,-1.33,;-8.09,-2.67,;-9.63,-2.67,;-10.4,-1.33,;-9.63,,;-8.09,,;-7.32,1.33,;-8.09,2.67,;-7.32,4,;-9.63,2.67,;-8.86,4,)|
Structure:
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