Ki Summary

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Target

Poly [ADP-ribose] polymerase tankyrase-2

Ligand

BDBM50579973

Substrate/Competitor

n/a

Meas. Tech.

Biochemical Assay

IC50

2.40±n/a nM

Citation

Krauss, S; Nazare, M; Lehtio, L; Waaler, J; Wegert, A; Leenders, RG 1,2,4-triazole derivatives as tankyrase inhibitors US Patent US11926614 Publication Date 3/12/2024

More Info.:

Get all data from this article, Assay Method

Poly [ADP-ribose] polymerase tankyrase-2

Name:

Poly [ADP-ribose] polymerase tankyrase-2

Synonyms:

Type:

Enzyme

Mol. Mass.:

126937.16

Organism:

Homo sapiens (Human)

Description:

Q9H2K2

Residue:

1166

Sequence:

MSGRRCAGGGAACASAAAEAVEPAARELFEACRNGDVERVKRLVTPEKVNSRDTAGRKST
PLHFAAGFGRKDVVEYLLQNGANVQARDDGGLIPLHNACSFGHAEVVNLLLRHGADPNAR
DNWNYTPLHEAAIKGKIDVCIVLLQHGAEPTIRNTDGRTALDLADPSAKAVLTGEYKKDE
LLESARSGNEEKMMALLTPLNVNCHASDGRKSTPLHLAAGYNRVKIVQLLLQHGADVHAK
DKGDLVPLHNACSYGHYEVTELLVKHGACVNAMDLWQFTPLHEAASKNRVEVCSLLLSYG
ADPTLLNCHNKSAIDLAPTPQLKERLAYEFKGHSLLQAAREADVTRIKKHLSLEMVNFKH
PQTHETALHCAAASPYPKRKQICELLLRKGANINEKTKEFLTPLHVASEKAHNDVVEVVV
KHEAKVNALDNLGQTSLHRAAYCGHLQTCRLLLSYGCDPNIISLQGFTALQMGNENVQQL
LQEGISLGNSEADRQLLEAAKAGDVETVKKLCTVQSVNCRDIEGRQSTPLHFAAGYNRVS
VVEYLLQHGADVHAKDKGGLVPLHNACSYGHYEVAELLVKHGAVVNVADLWKFTPLHEAA
AKGKYEICKLLLQHGADPTKKNRDGNTPLDLVKDGDTDIQDLLRGDAALLDAAKKGCLAR
VKKLSSPDNVNCRDTQGRHSTPLHLAAGYNNLEVAEYLLQHGADVNAQDKGGLIPLHNAA
SYGHVDVAALLIKYNACVNATDKWAFTPLHEAAQKGRTQLCALLLAHGADPTLKNQEGQT
PLDLVSADDVSALLTAAMPPSALPSCYKPQVLNGVRSPGATADALSSGPSSPSSLSAASS
LDNLSGSFSELSSVVSSSGTEGASSLEKKEVPGVDFSITQFVRNLGLEHLMDIFEREQIT
LDVLVEMGHKELKEIGINAYGHRHKLIKGVERLISGQQGLNPYLTLNTSGSGTILIDLSP
DDKEFQSVEEEMQSTVREHRDGGHAGGIFNRYNILKIQKVCNKKLWERYTHRRKEVSEEN
HNHANERMLFHGSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQYVYGIGGGTG
CPVHKDRSCYICHRQLLFCRVTLGKSFLQFSAMKMAHSPPGHHSVTGRPSVNGLALAEYV
IYRGEQAYPEYLITYQIMRPEGMVDG

BDBM50579973

n/a

Name

BDBM50579973

Synonyms:

CHEMBL5082704 | US11926614, Example 83

Type

Small organic molecule

Emp. Form.

C28H26N6O2S

Mol. Mass.

510.61

SMILES

CCOc1ccc(nc1)-c1nnc([C@H]2C[C@@H](C2)NC(=O)c2cccc3cccnc23)n1-c1ccc(C)s1 |r,wU:15.18,wD:13.13,(55.93,-41.05,;56.82,-39.82,;58.34,-39.97,;59.23,-38.74,;60.76,-38.9,;61.65,-37.67,;61.03,-36.28,;59.51,-36.12,;58.61,-37.35,;61.93,-35.05,;61.45,-33.58,;62.7,-32.67,;63.95,-33.58,;65.42,-33.09,;66.79,-33.8,;67.5,-32.43,;66.12,-31.72,;68.98,-31.95,;69.3,-30.44,;68.15,-29.4,;70.78,-29.96,;71.08,-28.44,;72.55,-27.96,;73.71,-29,;73.39,-30.51,;74.53,-31.54,;74.22,-33.05,;72.74,-33.53,;71.6,-32.5,;71.92,-30.99,;63.47,-35.05,;64.37,-36.29,;63.9,-37.74,;65.13,-38.63,;66.36,-37.74,;67.81,-38.21,;65.89,-36.29,)|

Structure