Reaction Details Report a problem with these data
Target
Tyrosine-protein kinase Tec
Ligand
BDBM164638
Substrate
n/a
Meas. Tech.
ChEMBL_1983372 (CHEMBL4616778)
IC50
0.900000±n/a nM
Citation
 Watterson, SH; Liu, Q; Beaudoin Bertrand, M; Batt, DG; Li, L; Pattoli, MA; Skala, S; Cheng, L; Obermeier, MT; Moore, R; Yang, Z; Vickery, R; Elzinga, PA; Discenza, L; D'Arienzo, C; Gillooly, KM; Taylor, TL; Pulicicchio, C; Zhang, Y; Heimrich, E; McIntyre, KW; Ruan, Q; Westhouse, RA; Catlett, IM; Zheng, N; Chaudhry, C; Dai, J; Galella, MA; Tebben, AJ; Pokross, M; Li, J; Zhao, R; Smith, D; Rampulla, R; Allentoff, A; Wallace, MA; Mathur, A; Salter-Cid, L; Macor, JE; Carter, PH; Fura, A; Burke, JR; Tino, JA Discovery of Branebrutinib (BMS-986195): A Strategy for Identifying a Highly Potent and Selective Covalent Inhibitor Providing Rapid in Vivo Inactivation of Bruton's Tyrosine Kinase (BTK). J Med Chem 62:3228-3250 (2019) [PubMed]  Article 
Target
Name:
Tyrosine-protein kinase Tec
Synonyms:
PSCTK4 | TEC | TEC_HUMAN | Tyrosine-protein kinase TEC (TEC)
Type:
Protein
Mol. Mass.:
73597.00
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
631
Sequence:
MNFNTILEEILIKRSQQKKKTSPLNYKERLFVLTKSMLTYYEGRAEKKYRKGFIDVSKIKCVEIVKNDDGVIPCQNKYPFQVVHDANTLYIFAPSPQSRDLWVKKLKEEIKNNNNIMIKYHPKFWTDGSYQCCRQTEKLAPGCEKYNLFESSIRKALPPAPETKKRRPPPPIPLEEEDNSEEIVVAMYDFQAAEGHDLRLERGQEYLILEKNDVHWWRARDKYGNEGYIPSNYVTGKKSNNLDQYEWYCRNMNRSKAEQLLRSEDKEGGFMVRDSSQPGLYTVSLYTKFGGEGSSGFRHYHIKETTTSPKKYYLAEKHAFGSIPEIIEYHKHNAAGLVTRLRYPVSVKGKNAPTTAGFSYEKWEINPSELTFMRELGSGLFGVVRLGKWRAQYKVAIKAIREGAMCEEDFIEEAKVMMKLTHPKLVQLYGVCTQQKPIYIVTEFMERGCLLNFLRQRQGHFSRDVLLSMCQDVCEGMEYLERNSFIHRDLAARNCLVSEAGVVKVSDFGMARYVLDDQYTSSSGAKFPVKWCPPEVFNYSRFSSKSDVWSFGVLMWEVFTEGRMPFEKYTNYEVVTMVTRGHRLYQPKLASNYVYEVMLRCWQEKPEGRPSFEDLLRTIDELVECEETFGR
  
Inhibitor
Name:
BDBM164638
Synonyms:
BDBM166759 | US10604504, Example 223 | US11623921, Example 223 | US9688629, 123 | US9802915, Example 123 | US9920031, Example 223
Type:
Small organic molecule
Emp. Form.:
C20H23FN4O2
Mol. Mass.:
370.4206
SMILES:
CC#CC(=O)N[C@H]1CCCN(C1)c1c(F)cc(C(N)=O)c2[nH]c(C)c(C)c12 |r|
Structure:
Search PDB for entries with ligand similarity: