Reaction Details Report a problem with these data
Target
Tubulin beta chain
Ligand
BDBM50217543
Substrate
n/a
Meas. Tech.
ChEMBL_157932 (CHEMBL765900)
IC50
3720±n/a nM
Citation
 Ohki, H; Hirotani, K; Naito, H; Ohsuki, S; Minami, M; Ejima, A; Koiso, Y; Hashimoto, Y Synthesis and mechanism of action of novel pyrimidinyl pyrazole derivatives possessing antiproliferative activity. Bioorg Med Chem Lett 12:3191-3 (2002) [PubMed]  Article 
Target
Name:
Tubulin beta chain
Synonyms:
Beta-tubulin | TBB_PIG | Tubulin beta chain
Type:
PROTEIN
Mol. Mass.:
49840.26
Organism:
Sus scrofa
Description:
ChEMBL_105107
Residue:
445
Sequence:
MREIVHIQAGQCGNQIGAKFWEVISDEHGIDPTGSYHGDSDLQLERINVYYNEAAGNKYVPRAILVDLEPGTMDSVRSGPFGQIFRPDNFVFGQSGAGNNWAKGHYTEGAELVDSVLDVVRKESESCDCLQGFQLTHSLGGGTGSGMGTLLISKIREEYPDRIMNTFSVVPSPKVSDTVVEPYNATLSVHQLVENTDETYCIDNEALYDICFRTLKLTTPTYGDLNHLVSATMSGVTTCLRFPGQLNADLRKLAVNMVPFPRLHFFMPGFAPLTSRGSQQYRALTVPELTQQMFDAKNMMAACDPRHGRYLTVAAVFRGRMSMKEVDEQMLNVQNKNSSYFVEWIPNNVKTAVCDIPPRGLKMSATFIGNSTAIQELFKRISEQFTAMFRRKAFLHWYTGEGMDEMEFTEAESNMNDLVSEYQQYQDATADEQGEFEEEGEEDEA
  
Inhibitor
Name:
BDBM50217543
Synonyms:
CHEMBL540565
Type:
Small organic molecule
Emp. Form.:
C21H24ClF2N7
Mol. Mass.:
447.912
SMILES:
Cl.Cc1c(\C=C\CN2CCN(CC2)c2cc(F)cc(F)c2)cnn1-c1ccnc(N)n1
Structure:
Search PDB for entries with ligand similarity: