Ki Summary

Reaction Details

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Target

Protein Nef

Ligand

BDBM288042

Substrate/Competitor

n/a

Meas. Tech.

Measurement of Antiviral (HIV-1) Activity

Temperature

298.15±n/a K

EC50

10.00±n/a nM

Comments

extracted

Citation

Miyazaki, S; Isoshima, H; Oshita, K; Kawashita, S; Nagahashi, N; Terashita, M Substituted spiropyrido[1,2-a]pyrazine derivative and medicinal use thereof as HIV integrase inhibitor US Patent US10087178 Publication Date 10/2/2018

More Info.:

Get all data from this article, Assay Method

Protein Nef

Name:

Protein Nef

Synonyms:

Type:

C-terminal core protein

Mol. Mass.:

23340.47

Organism:

Human immunodeficiency virus type 1 (isolate BRU/LAI group M subtype B)

Description:

P03406

Residue:

206

Sequence:

MGGKWSKSSVVGWPTVRERMRRAEPAADGVGAASRDLEKHGAITSSNTAATNAACAWLEA
QEEEEVGFPVTPQVPLRPMTYKAAVDLSHFLKEKGGLEGLIHSQRRQDILDLWIYHTQGY
FPDWQNYTPGPGVRYPLTFGWCYKLVPVEPDKVEEANKGENTSLLHPVSLHGMDDPEREV
LEWRFDSRLAFHHVARELHPEYFKNC

BDBM288042

n/a

Name

BDBM288042

Synonyms:

US10087178, Example S2 | cis-3-(benzyloxy)-N-(2,4- difluorobenzyl)-9'-hydroxy- 2'-isopropyl-1',8'-dioxo- 1',2',3',8'- tetrahydrospiro[cyclobutane- 1,4'-pyrido[1,2-a]pyrazine]- 7'-carboxamide hydrochloride

Type

Small organic molecule

Emp. Form.

C29H29F2N3O5

Mol. Mass.

537.5545

SMILES

CC(C)N1C[C@]2(C[C@@H](C2)OCc2ccccc2)n2cc(C(=O)NCc3ccc(F)cc3F)c(=O)c(O)c2C1=O |r,wU:5.8,wD:7.9,(6.67,4.55,;6.67,3.01,;8,2.24,;5.33,2.24,;5.33,.7,;4,-.07,;5.09,-1.15,;4,-2.24,;2.91,-1.15,;4,-3.78,;5.33,-4.55,;6.67,-3.78,;8,-4.55,;9.34,-3.78,;9.34,-2.24,;8,-1.47,;6.67,-2.24,;2.67,.7,;1.33,-.07,;,.7,;-1.33,-.07,;-1.33,-1.61,;-2.67,.7,;-4,-.07,;-5.33,.7,;-5.33,2.24,;-6.67,3.01,;-8,2.24,;-9.34,3.01,;-8,.7,;-6.67,-.07,;-6.67,-1.61,;,2.24,;-1.33,3.01,;1.33,3.01,;1.33,4.55,;2.67,2.24,;4,3.01,;4,4.55,)|

Structure