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Target
Nuclear receptor ROR-gamma
Ligand
BDBM50282096
Substrate
n/a
Meas. Tech.
ChEMBL_1722932 (CHEMBL4137932)
IC50
770±n/a nM
Citation
 Carcache, DA; Vulpetti, A; Kallen, J; Mattes, H; Orain, D; Stringer, R; Vangrevelinghe, E; Wolf, RM; Kaupmann, K; Ottl, J; Dawson, J; Cooke, NG; Hoegenauer, K; Billich, A; Wagner, J; Guntermann, C; Hintermann, S Optimizing a Weakly Binding Fragment into a Potent ROR?t Inverse Agonist with Efficacy in an in Vivo Inflammation Model. J Med Chem 61:6724-6735 (2018) [PubMed]  Article 
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:
BDBM50282096
Synonyms:
CHEMBL4161247
Type:
Small organic molecule
Emp. Form.:
C17H19ClN2O4S
Mol. Mass.:
382.862
SMILES:
CCOc1ncc(NC(=O)Cc2ccc(cc2)S(=O)(=O)CC)cc1Cl
Structure:
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