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Target
Receptor-interacting serine/threonine-protein kinase 2
Ligand
BDBM50467984
Substrate
n/a
Meas. Tech.
ChEMBL_1797531 (CHEMBL4269648)
IC50
13±n/a nM
Citation
 Haile, PA; Casillas, LN; Bury, MJ; Mehlmann, JF; Singhaus, R; Charnley, AK; Hughes, TV; DeMartino, MP; Wang, GZ; Romano, JJ; Dong, X; Plotnikov, NV; Lakdawala, AS; Convery, MA; Votta, BJ; Lipshutz, DB; Desai, BM; Swift, B; Capriotti, CA; Berger, SB; Mahajan, MK; Reilly, MA; Rivera, EJ; Sun, HH; Nagilla, R; LePage, C; Ouellette, MT; Totoritis, RD; Donovan, BT; Brown, BS; Chaudhary, KW; Gough, PJ; Bertin, J; Marquis, RW Identification of Quinoline-Based RIP2 Kinase Inhibitors with an Improved Therapeutic Index to the hERG Ion Channel. ACS Med Chem Lett 9:1039-1044 (2018) [PubMed]  Article 
Target
Name:
Receptor-interacting serine/threonine-protein kinase 2
Synonyms:
Receptor-interacting serine/threonine-protein kinase 2 | Ripk2 | Tyrosine-protein kinase RIPK2
Type:
PROTEIN
Mol. Mass.:
60785.84
Organism:
Rattus norvegicus
Description:
ChEMBL_116814
Residue:
539
Sequence:
MNGDAICSALPHIPYHKLADLHYLSRGASGTVSSARHADWRVRVAVKHLHIHTPLLDSERNDILREAEILHKARFSYILPILGICNEPEFLGIVTEYMPNGSLNELLHRKTEYPEIAWPLRFRILHEIALGVNYLHNMNPPLLHHDLKTQNILLDNEFHVKIADFGLSKWRMMSLSQSRSYKSAPEGGTIIYMPPENYEPGQKSRASVKHDIYSYAVIMWEVLSRKQPFEEVTNPLQIMYSVSQGHRPNTSEENLPFDIPHRGLMISLIQSGWAQNPDERPSFLKCLIELEPVLRTFEDITFLEAVIQLKKSKIQSASSTIHLCDKKMDLSLNIPASHPPQEESCGSSLLSRNAGSPGTSRSLSAPQDKGFFHGGPQDCSSSKAYHCPGNHSWDGIISVSQEAAFCDRRASSCSLTVIRPLLVEKSSERPQPGIAQQWIQSKREAIVSQMTEACLNQSLDALLSRDLIMKEDYELISTKPTRTAKVRQLLDTSDIQGEEFARVIVQKLKDNKQMGLQPYPEVLLVSRTPSSNVLQNKTL
  
Inhibitor
Name:
BDBM50467984
Synonyms:
CHEMBL4293287
Type:
Small organic molecule
Emp. Form.:
C19H24N4O3S
Mol. Mass.:
388.484
SMILES:
COc1cc2nccc(Nc3n[nH]c(C)c3C)c2cc1S(=O)(=O)C(C)(C)C
Structure:
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