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Target
Phosphatidylinositol 4-phosphate 5-kinase type-1 beta
Ligand
BDBM50599596
Substrate
n/a
Meas. Tech.
ChEMBL_2231146 (CHEMBL5144918)
IC50
35±n/a nM
Citation
 Andrews, DM; Cartic, S; Cosulich, S; Divecha, N; Faulder, P; Flemington, V; Kern, O; Kettle, JG; MacDonald, E; McKelvie, J; Pike, KG; Roberts, B; Rowlinson, R; Smith, JM; Stockley, M; Swarbrick, ME; Treinies, I; Waring, MJ Identification and optimization of a novel series of selective PIP5K inhibitors. Bioorg Med Chem 54:0 (2022) [PubMed] 
Target
Name:
Phosphatidylinositol 4-phosphate 5-kinase type-1 beta
Synonyms:
2.7.1.68 | PI51B_HUMAN | PIP5K1-beta | PIP5K1B | PIP5KIbeta | Phosphatidylinositol 4-phosphate 5-kinase type I beta | Protein STM-7 | PtdIns(4)P-5-kinase 1 beta | STM7 | Synonyms=STM7 | Type I phosphatidylinositol 4-phosphate 5-kinase beta
Type:
PROTEIN
Mol. Mass.:
61038.12
Organism:
Homo sapiens
Description:
ChEMBL_120312
Residue:
540
Sequence:
MSSAAENGEAAPGKQNEEKTYKKTASSAIKGAIQLGIGYTVGNLTSKPERDVLMQDFYVVESVFLPSEGSNLTPAHHYPDFRFKTYAPLAFRYFRELFGIKPDDYLYSICSEPLIELSNPGASGSLFFVTSDDEFIIKTVQHKEAEFLQKLLPGYYMNLNQNPRTLLPKFYGLYCMQSGGINIRIVVMNNVLPRSMRMHFTYDLKGSTYKRRASRKEREKSNPTFKDLDFLQDMHEGLYFDTETYNALMKTLQRDCRVLESFKIMDYSLLLGIHFLDHSLKEKEEETPQNVPDAKRTGMQKVLYSTAMESIQGPGKSGDGIITENPDTMGGIPAKSHRGEKLLLFMGIIDILQSYRLMKKLEHSWKALVYDGDTVSVHRPSFYADRFLKFMNSRVFKKIQALKASPSKKRCNSIAALKATSQEIVSSISQEWKDEKRDLLTEGQSFSSLDEEALGSRHRPDLVPSTPSLFEAASLATTISSSSLYVNEHYPHDRPTLYSNSKGLPSSSTFTLEEGTIYLTAEPNTLEVQDDNASVLDVYL
  
Inhibitor
Name:
BDBM50599596
Synonyms:
CHEMBL5191668
Type:
Small organic molecule
Emp. Form.:
C25H26N4O3
Mol. Mass.:
430.4989
SMILES:
CC(=O)Nc1cc(Nc2ccccc2)cc(c1)-c1ccnc(NC(=O)C2CCOCC2)c1
Structure:
Search PDB for entries with ligand similarity: