Ki Summary

Reaction Details

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Target

WD repeat-containing protein 5

Ligand

BDBM50318542

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_633068 (CHEMBL1118768)

IC50

80±n/a nM

Citation

Karatas, H; Townsend, EC; Bernard, D; Dou, Y; Wang, S Analysis of the binding of mixed lineage leukemia 1 (MLL1) and histone 3 peptides to WD repeat domain 5 (WDR5) for the design of inhibitors of the MLL1-WDR5 interaction. J Med Chem53:5179-85 (2010) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

WD repeat-containing protein 5

Name:

WD repeat-containing protein 5

Synonyms:

Type:

Protein

Mol. Mass.:

36597.13

Organism:

Homo sapiens (Human)

Description:

P61964

Residue:

334

Sequence:

MATEEKKPETEAARAQPTPSSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWL
ASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGK
CLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFN
RDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKL
WDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGH
TDVVISTACHPTENIIASAALENDKTIKLWKSDC

BDBM50318542

n/a

Name

BDBM50318542

Synonyms:

CHEMBL1086451 | H2N-SARAEVHLRKS-NH2

Type

Small organic molecule

Emp. Form.

C52H93N21O15

Mol. Mass.

1252.4265

SMILES

CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(N)=O |r,wU:31.32,47.48,4.4,73.73,18.19,wD:52.53,8.15,36.44,22.28,62.62,82.82,(25.54,-40.4,;25.54,-41.92,;26.9,-42.71,;24.18,-42.71,;24.18,-44.24,;22.86,-45.02,;21.53,-44.24,;21.53,-42.71,;20.2,-45,;20.2,-46.56,;21.53,-47.33,;22.93,-46.74,;23.96,-47.89,;23.17,-49.22,;21.68,-48.86,;18.88,-44.22,;17.55,-44.99,;17.55,-46.56,;16.19,-44.22,;14.86,-44.98,;13.53,-44.21,;13.53,-42.68,;12.21,-44.97,;12.21,-46.54,;13.53,-47.31,;13.53,-48.87,;12.15,-49.63,;14.85,-49.63,;10.88,-44.19,;9.57,-45.01,;9.57,-46.58,;8.22,-44.23,;8.22,-42.7,;6.86,-44.96,;5.52,-44.2,;5.52,-42.67,;4.2,-44.96,;4.2,-46.53,;5.52,-47.29,;5.52,-48.86,;6.86,-49.61,;6.91,-51.15,;5.5,-51.91,;8.2,-51.86,;2.87,-44.18,;1.58,-45.01,;1.58,-46.58,;.22,-44.22,;.22,-42.7,;-1.12,-44.98,;-2.46,-44.22,;-2.46,-42.69,;-3.79,-44.99,;-5.12,-44.22,;-3.79,-46.55,;-2.52,-47.21,;16.19,-42.69,;17.55,-41.9,;14.87,-41.92,;25.54,-45.02,;25.54,-46.58,;26.86,-44.23,;28.2,-44.99,;28.2,-46.56,;29.52,-47.32,;29.52,-48.89,;30.84,-49.67,;30.85,-51.21,;29.49,-52.01,;32.17,-51.98,;29.52,-44.23,;29.52,-42.7,;30.85,-45,;32.18,-44.23,;32.18,-42.7,;33.53,-41.92,;33.53,-40.39,;34.89,-39.61,;34.88,-38.09,;33.53,-45.01,;33.53,-46.58,;34.87,-44.24,;36.2,-45.01,;36.2,-46.57,;37.53,-47.33,;37.53,-44.24,;38.89,-45.02,;37.53,-42.72,)|

Structure