Bicarbonate

Bicarbonate

SCHEMBL4398583

CNc1ncc2c(n1)N(C1CCCCC1)C(=O)N(c1c(F)c(OC)cc(OC)c1F)C2.O=C(O)O

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 13/20 0.57
FGFR2 P21802 8/20 0.57
FGFR3 P22607 7/20 0.57
FGFR4 P22455 13/20 0.57

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
SCHEMBL4398577 0.91 FGFR1 (0.55) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4396227 0.90 FGFR1 (0.62) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4399055 0.88 FGFR1 (0.57) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4403354 0.88 FGFR1 (0.54) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4405971 0.87 FGFR1 (0.54) FGFR1FGFR2FGFR3FGFR4
Trifluoroacetic Acid SCHEMBL5799247 0.87 FGFR1 (0.52) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4405739 0.86 FGFR1 (0.53) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4398452 0.86 FGFR1 (0.51) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4405973 0.85 FGFR1 (0.54) FGFR1FGFR2FGFR3FGFR4
SCHEMBL4405617 0.85 FGFR1 (0.61) FGFR1FGFR2FGFR3FGFR4

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-1549651-B1 PYRIMIDOPYRIMIDONES AS KINASE INHIBITORS WARNER LAMBERT CO (US) 2009-12-23 EP claimed