Reaction Details Report a problem with these data
Target
Apoptosis regulator Bcl-2 [1-211]
Ligand
BDBM544474
Substrate
n/a
Meas. Tech.
Biological Assay 2
IC50
>20000±n/a nM
Citation
 Ferrara, SJ; Serrano-Wu, MH; Lemke, C; McKinney, D; Fitzgerald, M; Nasveschuk, C; Lazarski, K; Furst, L; Wei, G; McCarren, PR; Thede, K; Mengel, A; Christ, C; Kuhnke, J; Johannes, SA; Buchgraber, P; Klar, U; Sack, U; Kaulfuss, S; Fernandez-Montalvan, AE; Werbeck, N; Mönning, U Macrocyclic fluorine substituted indole derivatives US Patent  US11286263 Publication Date 3/29/2022 
Target
Name:
Apoptosis regulator Bcl-2 [1-211]
Synonyms:
BCL2 | BCL2_HUMAN
Type:
Protein
Mol. Mass.:
23308.03
Organism:
Homo sapiens (Human)
Description:
P10415[1-211]
Residue:
211
Sequence:
MAHAGRTGYDNREIVMKYIHYKLSQRGYEWDAGDVGAAPPGAAPAPGIFSSQPGHTPHPAASRDPVARTSPLQTPAAPGAAAGPALSPVPPVVHLTLRQAGDDFSRRYRRDFAEMSSQLHLTPFTARGRFATVVEELFRDGVNWGRIVAFFEFGGVMCVESVNREMSPLVDNIALWMTEYLNRHLHTWIQDNGGWDAFVELYGPSMRPLFD
  
Inhibitor
Name:
BDBM544474
Synonyms:
(rac)-13-fluoro-10,12-dimethyl-1-(3-(naphthalen-1-yloxy)propyl)-4,5,6,7,9,10-hexahydro-pyrazolo[4′,3′:9,10][1]oxa[6]azacycloundecino[8,7,6-hi]indole-2-carboxylic acid | US11286263, Example 10
Type:
Small organic molecule
Emp. Form.:
C32H32FN3O4
Mol. Mass.:
541.6126
SMILES:
Cc1nn(C)c2COCCCCn3c(C(O)=O)c(CCCOc4cccc5ccccc45)c4ccc(F)c(-c12)c34
Structure:
Search PDB for entries with ligand similarity: