SCHEMBL4718700

SCHEMBL4718700

NCc1cccc(-n2c(-c3nonc3N)nc3cnccc32)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 15/20 1.00
DYRK1A Q13627 2/20 0.59
RPS6KB1 P23443 4/20 0.55
ROCK1 Q13464 2/20 0.55
CDK2 P24941 1/20 0.55
RPS6KA1 Q15418 1/20 0.55
PRKACA P17612 1/20 0.54
GSK3B P49841 1/20 0.54
KCNK13 Q9HB14 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4714617 0.89 RPS6KA5 (1.00) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4716547 0.87 RPS6KA5 (0.77) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4718407 0.85 RPS6KA5 (0.76) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4716310 0.85 RPS6KA5 (0.76) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4717298 0.85 RPS6KA5 (0.76) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4714283 0.84 RPS6KA5 (1.00) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4714200 0.83 RPS6KB1 (0.77) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4714521 0.82 RPS6KA5 (0.71) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4718574 0.82 RPS6KA5 (0.69) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2
SCHEMBL4718298 0.80 RPS6KA5 (0.82) RPS6KA5DYRK1ARPS6KB1ROCK1CDK2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490367-B1 IMIDAZOPYRIDINE DERIVATIVES AS KINASE INHIBITORS GLAXO GROUP LTD (GB) 2008-07-23 EP disclosed