Reaction Details Report a problem with these data
Target
Fascin
Ligand
BDBM50526239
Substrate
n/a
Meas. Tech.
ChEMBL_1899436 (CHEMBL4401551)
Kd
92000±n/a nM
Citation
 Francis, S; Croft, D; Schüttelkopf, AW; Parry, C; Pugliese, A; Cameron, K; Claydon, S; Drysdale, M; Gardner, C; Gohlke, A; Goodwin, G; Gray, CH; Konczal, J; McDonald, L; Mezna, M; Pannifer, A; Paul, NR; Machesky, L; McKinnon, H; Bower, J Structure-based design, synthesis and biological evaluation of a novel series of isoquinolone and pyrazolo[4,3-c]pyridine inhibitors of fascin 1 as potential anti-metastatic agents. Bioorg Med Chem Lett 29:1023-1029 (2019) [PubMed]  Article 
Target
Name:
Fascin
Synonyms:
55 kDa actin-bundling protein | FAN1 | FSCN1 | FSCN1_HUMAN | HSN | SNL | Singed-like protein | p55
Type:
Enzyme Catalytic Domain
Mol. Mass.:
54533.89
Organism:
Homo sapiens (human)
Description:
n/a
Residue:
493
Sequence:
MTANGTAEAVQIQFGLINCGNKYLTAEAFGFKVNASASSLKKKQIWTLEQPPDEAGSAAVCLRSHLGRYLAADKDGNVTCEREVPGPDCRFLIVAHDDGRWSLQSEAHRRYFGGTEDRLSCFAQTVSPAEKWSVHIAMHPQVNIYSVTRKRYAHLSARPADEIAVDRDVPWGVDSLITLAFQDQRYSVQTADHRFLRHDGRLVARPEPATGYTLEFRSGKVAFRDCEGRYLAPSGPSGTLKAGKATKVGKDELFALEQSCAQVVLQAANERNVSTRQGMDLSANQDEETDQETFQLEIDRDTKKCAFRTHTGKYWTLTATGGVQSTASSKNASCYFDIEWRDRRITLRASNGKFVTSKKNGQLAASVETAGDSELFLMKLINRPIIVFRGEHGFIGCRKVTGTLDANRSSYDVFQLEFNDGAYNIKDSTGKYWTVGSDSAVTSSGDTPVDFFFEFCDYNKVAIKVGGRYLKGDHAGVLKASAETVDPASLWEY
  
Inhibitor
Name:
BDBM50526239
Synonyms:
CHEMBL4592515
Type:
Small organic molecule
Emp. Form.:
C9H9Cl2NO
Mol. Mass.:
218.08
SMILES:
CN(C(C)=O)c1ccc(Cl)cc1Cl
Structure:
Search PDB for entries with ligand similarity: