Ki Summary

Reaction Details

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Target

Bromodomain testis-specific protein [21-137]

Ligand

BDBM205446

Substrate/Competitor

n/a

Meas. Tech.

AlphaScreen BRD Binding Assay

7.5±n/a

Temperature

298.15±n/a K

IC50

31.7±0.0 nM

Comments

extracted

Citation

Tanaka, M; Roberts, JM; Seo, HS; Souza, A; Paulk, J; Scott, TG; DeAngelo, SL; Dhe-Paganon, S; Bradner, JE Design and characterization of bivalent BET inhibitors. Nat Chem Biol12:1089-1096 (2016) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Bromodomain testis-specific protein [21-137]

Name:

Bromodomain testis-specific protein [21-137]

Synonyms:

BRDT | BRDT_HUMAN | Bromodomain testis 1 (BRDT(1))

Type:

n/a

Mol. Mass.:

13934.55

Organism:

Homo sapiens (Human)

Description:

Q58F21 (BRDT, 21-137)

Residue:

117

Sequence:

NTKKNGRLTNQLQYLQKVVLKDLWKHSFSWPFQRPVDAVKLQLPDYYTIIKNPMDLNTIK
KRLENKYYAKASECIEDFNTMFSNCYLYNKPGDDIVLMAQALEKLFMQKLSQMPQEE

BDBM205446

n/a

Name

BDBM205446

Synonyms:

2S+IBET-PEG3 (26)

Type

Small organic molecule

Emp. Form.

C53H56ClN11O10S

Mol. Mass.

1074.597

SMILES

COC(=O)CC1N=C(c2c(C)c(sc2-n2c(C)nnc12)C(=O)NCCOCCOCCOCCNC(=O)Cn1c2cnc3cc(-c4c(C)noc4C)c(OC)cc3c2n([C@H](C)c2ccccn2)c1=O)c1ccc(Cl)cc1 |r,wD:59.65,c:6,(-7.04,.67,;-5.55,1.41,;-4.29,.29,;-4.45,-1.26,;-3.21,1.04,;-1.88,.27,;-1.26,-1.14,;.23,-1.54,;1.47,-.62,;2.95,-1.02,;3.72,-2.36,;3.79,.27,;2.82,1.46,;1.52,.91,;.36,1.92,;.51,3.48,;1.84,4.25,;-.9,4.11,;-1.93,2.97,;-1.16,1.63,;5.34,.14,;5.75,-1.4,;6.84,1.15,;7.93,.06,;9.26,.83,;10.6,.06,;11.93,.83,;13.26,.06,;14.6,.83,;15.69,-.26,;17.02,.51,;18.11,-.58,;19.44,.19,;20.78,-.58,;22.36,.11,;24.13,-1.1,;24.02,-3.19,;25.22,-.01,;26.55,-.78,;27.71,-.01,;27.71,1.53,;29.04,2.3,;30.38,1.53,;31.71,2.3,;33.05,1.53,;34.38,2.3,;35.71,1.53,;35.71,-.01,;36.8,2.62,;36.1,3.99,;34.58,3.75,;33.49,4.84,;33.05,-.01,;34.38,-.78,;35.71,-1.55,;31.71,-.78,;30.38,-.01,;29.04,-.78,;28.57,-2.25,;29.57,-3.18,;31.11,-2.8,;29.13,-4.35,;27.59,-4.35,;26.82,-5.69,;27.59,-7.02,;29.13,-7.02,;29.9,-5.69,;27.03,-2.25,;26.26,-3.58,;.63,-3.03,;2.11,-3.43,;2.51,-4.91,;1.42,-6,;1.82,-7.49,;-.06,-5.6,;-.46,-4.12,)|

Structure