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Target
Apoptosis regulator Bcl-2
Ligand
BDBM50589737
Substrate
n/a
Meas. Tech.
ChEMBL_2194218 (CHEMBL5106578)
Ki
710±n/a nM
Citation
 Drennen, B; Goodis, CC; Bowen, N; Yu, W; Vickers, G; Wilder, PT; MacKerell, AD; Fletcher, S Scaffold hopping from indoles to indazoles yields dual MCL-1/BCL-2 inhibitors from MCL-1 selective leads. RSC Med Chem 13:963-969 (2022) [PubMed] 
Target
Name:
Apoptosis regulator Bcl-2
Synonyms:
Apoptosis regulator Bcl-2 Protein | B-cell lymphoma 2 protein (Bcl-2) | BCL-2 | BCL2 | BCL2_HUMAN | Bcl-2 Protein
Type:
Homodimer or heterodimer
Mol. Mass.:
26269.11
Organism:
Homo sapiens (Human)
Description:
P10415
Residue:
239
Sequence:
MAHAGRTGYDNREIVMKYIHYKLSQRGYEWDAGDVGAAPPGAAPAPGIFSSQPGHTPHPAASRDPVARTSPLQTPAAPGAAAGPALSPVPPVVHLTLRQAGDDFSRRYRRDFAEMSSQLHLTPFTARGRFATVVEELFRDGVNWGRIVAFFEFGGVMCVESVNREMSPLVDNIALWMTEYLNRHLHTWIQDNGGWDAFVELYGPSMRPLFDFSWLSLKTLLSLALVGACITLGAYLGHK
  
Inhibitor
Name:
BDBM50589737
Synonyms:
CHEMBL5192774
Type:
Small organic molecule
Emp. Form.:
C34H29Cl2N7O6S
Mol. Mass.:
734.608
SMILES:
Cc1cc(Oc2ccc(Cn3nc4ccc(Cl)cc4c3C(=O)NS(=O)(=O)c3ccc(c(NCc4ccn(C)n4)c3)[N+]([O-])=O)cc2)cc(C)c1Cl
Structure:
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