Ki Summary

Reaction Details

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Target

B-cell CLL/lymphoma 9 protein

Ligand

BDBM50409818

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_2268492

IC50

1200±n/a nM

Citation

Li, Z; Zhang, M; Teuscher, KB; Ji, H Discovery of 1-Benzoyl 4-Phenoxypiperidines as Small-Molecule Inhibitors of the ?-Catenin/B-Cell Lymphoma 9 Protein-Protein Interaction. J Med Chem64:11195-11218 (2021) [PubMed]

More Info.:

Get all data from this article, Assay Method

B-cell CLL/lymphoma 9 protein

Name:

B-cell CLL/lymphoma 9 protein

Synonyms:

Type:

PROTEIN

Mol. Mass.:

149313.19

Organism:

Homo sapiens

Description:

ChEMBL_117069

Residue:

1426

Sequence:

MHSSNPKVRSSPSGNTQSSPKSKQEVMVRPPTVMSPSGNPQLDSKFSNQGKQGGSASQSQ
PSPCDSKSGGHTPKALPGPGGSMGLKNGAGNGAKGKGKRERSISADSFDQRDPGTPNDDS
DIKECNSADHIKSQDSQHTPHSMTPSNATAPRSSTPSHGQTTATEPTPAQKTPAKVVYVF
STEMANKAAEAVLKGQVETIVSFHIQNISNNKTERSTAPLNTQISALRNDPKPLPQQPPA
PANQDQNSSQNTRLQPTPPIPAPAPKPAAPPRPLDRESPGVENKLIPSVGSPASSTPLPP
DGTGPNSTPNNRAVTPVSQGSNSSSADPKAPPPPPVSSGEPPTLGENPDGLSQEQLEHRE
RSLQTLRDIQRMLFPDEKEFTGAQSGGPQQNPGVLDGPQKKPEGPIQAMMAQSQSLGKGP
GPRTDVGAPFGPQGHRDVPFSPDEMVPPSMNSQSGTIGPDHLDHMTPEQIAWLKLQQEFY
EEKRRKQEQVVVQQCSLQDMMVHQHGPRGVVRGPPPPYQMTPSEGWAPGGTEPFSDGINM
PHSLPPRGMAPHPNMPGSQMRLPGFAGMINSEMEGPNVPNPASRPGLSGVSWPDDVPKIP
DGRNFPPGQGIFSGPGRGERFPNPQGLSEEMFQQQLAEKQLGLPPGMAMEGIRPSMEMNR
MIPGSQRHMEPGNNPIFPRIPVEGPLSPSRGDFPKGIPPQMGPGRELEFGMVPSGMKGDV
NLNVNMGSNSQMIPQKMREAGAGPEEMLKLRPGGSDMLPAQQKMVPLPFGEHPQQEYGMG
PRPFLPMSQGPGSNSGLRNLREPIGPDQRTNSRLSHMPPLPLNPSSNPTSLNTAPPVQRG
LGRKPLDISVAGSQVHSPGINPLKSPTMHQVQSPMLGSPSGNLKSPQTPSQLAGMLAGPA
AAASIKSPPVLGSAAASPVHLKSPSLPAPSPGWTSSPKPPLQSPGIPPNHKAPLTMASPA
MLGNVESGGPPPPTASQPASVNIPGSLPSSTPYTMPPEPTLSQNPLSIMMSRMSKFAMPS
STPLYHDAIKTVASSDDDSPPARSPNLPSMNNMPGMGINTQNPRISGPNPVVPMPTLSPM
GMTQPLSHSNQMPSPNAVGPNIPPHGVPMGPGLMSHNPIMGHGSQEPPMVPQGRMGFPQG
FPPVQSPPQQVPFPHNGPSGGQGSFPGGMGFPGEGPLGRPSNLPQSSADAALCKPGGPGG
PDSFTVLGNSMPSVFTDPDLQEVIRPGATGIPEFDLSRIIPSEKPSQTLQYFPRGEVPGR
KQPQGPGPGFSHMQGMMGEQAPRMGLALPGMGGPGPVGTPDIPLGTAPSMPGHNPMRPPA
FLQQGMMGPHHRMMSPAQSTMPGQPTLMSNPAAAVGMIPGKDRGPAGLYTHPGPVGSPGM
MMSMQGMMGPQQNIMIPPQMRPRGMAADVGMGGFSQGPGNPGNMMF

BDBM50409818

n/a

Name

BDBM50409818

Synonyms:

CHEMBL5280053

Type

Small organic molecule

Emp. Form.

C37H53Cl2N5O3

Mol. Mass.

686.754

SMILES

Cl.Cl.CC(C)(C)C1CCC(CC1)c1cc(ccc1O[C@H]1CCNC1)C(=O)N1CCC(CC1)Oc1cc(ccc1C#N)N1CCNCC1 |r,wD:19.18,(-10.24,-4.87,;9.83,-5.08,;11.98,3.1,;10.7,3.87,;11.98,4.64,;10.7,5.41,;9.36,3.1,;9.36,1.56,;8.03,.8,;6.7,1.56,;6.7,3.1,;8.03,3.87,;5.36,.8,;4.03,1.56,;2.69,.8,;2.69,-.74,;4.03,-1.51,;5.36,-.74,;6.7,-1.51,;6.7,-3.05,;5.41,-3.92,;5.93,-5.41,;7.47,-5.41,;7.93,-3.92,;1.36,1.56,;1.36,3.1,;.03,.8,;-1.31,1.56,;-2.64,.8,;-2.64,-.74,;-1.31,-1.51,;.03,-.74,;-3.98,-1.51,;-5.31,-.74,;-6.64,-1.51,;-7.98,-.74,;-7.98,.8,;-6.64,1.56,;-5.31,.8,;-3.98,1.56,;-2.64,2.33,;-9.31,-1.51,;-10.65,-.74,;-11.98,-1.51,;-11.98,-3.05,;-10.65,-3.82,;-9.31,-3.05,)|

Structure