Ki Summary

Reaction Details

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Target

Serine/threonine-protein kinase Chk1

Ligand

BDBM50204706

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_442099 (CHEMBL891237)

IC50

20±n/a nM

Citation

Tong, Y; Claiborne, A; Stewart, KD; Park, C; Kovar, P; Chen, Z; Credo, RB; Gu, WZ; Gwaltney, SL; Judge, RA; Zhang, H; Rosenberg, SH; Sham, HL; Sowin, TJ; Lin, NH Discovery of 1,4-dihydroindeno[1,2-c]pyrazoles as a novel class of potent and selective checkpoint kinase 1 inhibitors. Bioorg Med Chem15:2759-67 (2007) [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

BDBM50204706

n/a

Name

BDBM50204706

Synonyms:

4-{6-[(cis-4-methyl-cyclohexylamino)-methyl]-1,4-dihydro-indeno[1,2-c]pyrazol-3-yl}-benzoic acid | CHEMBL242737 | cis-4-(6-((4-methylcyclohexylamino)methyl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)benzoic acid

Type

Small organic molecule

Emp. Form.

C25H27N3O2

Mol. Mass.

401.5008

SMILES

C[C@H]1CC[C@H](CC1)NCc1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)C(O)=O)c1 |wU:4.7,1.0,(-9.25,-12.15,;-7.92,-11.38,;-7.91,-9.84,;-6.58,-9.08,;-5.24,-9.86,;-5.24,-11.39,;-6.59,-12.16,;-3.91,-9.09,;-2.57,-9.86,;-1.24,-9.09,;-1.24,-7.55,;.09,-6.78,;1.42,-7.54,;1.42,-9.09,;2.9,-9.57,;3.81,-8.32,;5.29,-7.84,;5.3,-6.29,;3.82,-5.8,;2.9,-7.06,;6.54,-8.74,;6.37,-10.28,;7.61,-11.18,;9.02,-10.56,;9.18,-9.02,;7.94,-8.12,;10.27,-11.46,;11.67,-10.84,;10.11,-12.99,;.09,-9.86,)|

Structure