Ki Summary

Reaction Details

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Target

Aurora kinase A

Ligand

BDBM50106630

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1508718 (CHEMBL3602981)

2.2±n/a nM

Citation

Lavogina, D; Kisand, K; Raidaru, G; Uri, A Fluorescent photoaffinity probes for mitotic protein kinase Aurora A. Bioorg Med Chem Lett25:3290-4 (2015) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Aurora kinase A

Name:

Aurora kinase A

Synonyms:

Type:

Serine/threonine-protein kinase

Mol. Mass.:

45830.98

Organism:

Homo sapiens (Human)

Description:

O14965

Residue:

403

Sequence:

MDRSKENCISGPVKATAPVGGPKRVLVTQQFPCQNPLPVNSGQAQRVLCPSNSSQRVPLQ
AQKLVSSHKPVQNQKQKQLQATSVPHPVSRPLNNTQKSKQPLPSAPENNPEEELASKQKN
EESKKRQWALEDFEIGRPLGKGKFGNVYLAREKQSKFILALKVLFKAQLEKAGVEHQLRR
EVEIQSHLRHPNILRLYGYFHDATRVYLILEYAPLGTVYRELQKLSKFDEQRTATYITEL
ANALSYCHSKRVIHRDIKPENLLLGSAGELKIADFGWSVHAPSSRRTTLCGTLDYLPPEM
IEGRMHDEKVDLWSLGVLCYEFLVGKPPFEANTYQETYKRISRVEFTFPDFVTEGARDLI
SRLLKHNPSQRPMLREVLEHPWITANSSKPSNCQNKESASKQS

BDBM50106630

n/a

Name

BDBM50106630

Synonyms:

CHEMBL3600760

Type

Small organic molecule

Emp. Form.

C69H77ClFN12O11S

Mol. Mass.

1336.939

SMILES

CN(C)c1ccc2c(-c3ccc(cc3C(O)=O)C(=O)NCCCOCCOCCOCCCNC(=O)[C@@H](Cc3ccc(cc3)N=[N+]=[N-])NC(=O)CCNC(=O)[C@@]3(Cc4cccc(Nc5nccs5)n4)CC[C@@H](CC3)Oc3cccc(Cl)c3F)c3ccc(cc3oc2c1)=[N+](C)C |r,wU:55.56,36.37,wD:71.78,(-6.4,.92,;-5.34,1.54,;-5.34,2.77,;-4,.77,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;,-1.54,;0,-3.08,;1.34,-3.84,;1.35,-5.38,;.03,-6.16,;-1.31,-5.4,;-1.32,-3.86,;-2.66,-3.1,;-2.67,-2.07,;-3.73,-3.73,;.04,-7.7,;-1.02,-8.33,;1.38,-8.46,;1.39,-10,;2.74,-10.76,;2.75,-12.3,;4.09,-13.06,;4.1,-14.6,;5.44,-15.36,;5.46,-16.9,;6.8,-17.66,;6.81,-19.2,;8.15,-19.96,;8.17,-21.5,;9.51,-22.26,;9.52,-23.8,;10.86,-24.56,;10.88,-26.1,;9.81,-26.73,;12.22,-26.86,;13.54,-26.08,;13.53,-24.54,;14.85,-23.75,;14.83,-22.21,;13.49,-21.46,;12.17,-22.24,;12.18,-23.78,;13.47,-19.92,;12.12,-19.16,;11.05,-18.56,;12.23,-28.4,;13.57,-29.16,;14.63,-28.54,;13.58,-30.7,;14.93,-31.46,;14.94,-33,;16.28,-33.76,;17.34,-33.14,;16.29,-35.3,;17.64,-36.06,;18.96,-35.28,;18.95,-33.74,;20.27,-32.96,;21.62,-33.71,;21.63,-35.25,;22.97,-36.01,;24.3,-35.22,;24.42,-33.7,;25.92,-33.36,;26.71,-34.68,;25.7,-35.84,;20.3,-36.04,;16.34,-36.82,;15.02,-37.6,;13.68,-36.84,;13.66,-35.3,;14.99,-34.52,;12.35,-37.63,;12.37,-39.17,;13.71,-39.92,;13.73,-41.46,;12.4,-42.25,;11.06,-41.5,;10,-42.12,;11.04,-39.96,;9.97,-39.35,;1.31,-.77,;2.67,-1.54,;4,-.77,;4,.77,;2.67,1.54,;1.31,.77,;,1.54,;-1.33,.77,;-2.67,1.54,;5.33,1.54,;6.4,.93,;5.33,2.78,)|

Structure