Ki Summary

Reaction Details

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Target

Serine/threonine-protein kinase Chk1

Ligand

BDBM50330775

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_685392 (CHEMBL1287592)

IC50

22±n/a nM

Citation

Sako, Y; Ichikawa, S; Osada, A; Matsuda, A Synthesis and evaluation of 5-substituted 9-hydroxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-diones as check point 1 kinase inhibitors. Bioorg Med Chem18:7878-89 (2010) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Serine/threonine-protein kinase Chk1

Name:

Serine/threonine-protein kinase Chk1

Synonyms:

CHEK1 | CHK1 | CHK1 checkpoint homolog | CHK1_HUMAN | Checkpoint kinase-1 (CHK1)

Type:

Enzyme Catalytic Domain

Mol. Mass.:

54443.02

Organism:

Homo sapiens (Human)

Description:

gi_166295192

Residue:

476

Sequence:

MAVPFVEDWDLVQTLGEGAYGEVQLAVNRVTEEAVAVKIVDMKRAVDCPENIKKEICINK
MLNHENVVKFYGHRREGNIQYLFLEYCSGGELFDRIEPDIGMPEPDAQRFFHQLMAGVVY
LHGIGITHRDIKPENLLLDERDNLKISDFGLATVFRYNNRERLLNKMCGTLPYVAPELLK
RREFHAEPVDVWSCGIVLTAMLAGELPWDQPSDSCQEYSDWKEKKTYLNPWKKIDSAPLA
LLHKILVENPSARITIPDIKKDRWYNKPLKKGAKRPRVTSGGVSESPSGFSKHIQSNLDF
SPVNSASSEENVKYSSSQPEPRTGLSLWDTSPSYIDKLVQGISFSQPTCPDHMLLNSQLL
GTPGSSQNPWQRLVKRMTRFFTKLDADKSYQCLKETCEKLGYQWKKSCMNQVTISTTDRR
NNKLIFKVNLLEMDDKILVDFRLSKGDGLEFKRHFLKIKGKLIDIVSSQKIWLPAT

BDBM50330775

n/a

Name

BDBM50330775

Synonyms:

5-{3-[3-(Guanidino)propylcarbamoyl]benzylaminocarboyl}-9-hydroxy-1,3-dihydropyrrolo[3,4-c]carbazole-1,3-(2H,6H)-dione hydrochloride | CHEMBL1277132

Type

Small organic molecule

Emp. Form.

C27H25N7O5

Mol. Mass.

527.5313

SMILES

NC(N)=NCCCNC(=O)c1cccc(CNC(=O)c2cc3C(=O)NC(=O)c3c3c4cc(O)ccc4[nH]c23)c1 |(47.46,-28,;45.93,-28,;45.16,-29.33,;45.16,-26.67,;43.63,-26.67,;42.86,-25.35,;41.33,-25.35,;40.56,-24.03,;39.02,-24.03,;38.25,-25.37,;38.26,-22.71,;39.02,-21.38,;38.23,-20.05,;36.7,-20.07,;35.95,-21.42,;34.41,-21.42,;33.65,-20.1,;32.12,-20.1,;31.35,-21.43,;31.35,-18.77,;32.11,-17.43,;31.32,-16.11,;31.79,-14.64,;33.24,-14.16,;30.54,-13.74,;29.3,-14.65,;27.84,-14.19,;29.78,-16.12,;29.03,-17.45,;27.52,-17.78,;26.27,-16.88,;24.87,-17.51,;23.63,-16.61,;24.71,-19.04,;25.95,-19.94,;27.36,-19.32,;28.78,-19.94,;29.8,-18.78,;36.72,-22.73,)|

Structure