Bicarbonate

Bicarbonate

SCHEMBL18203151

Cc1cc(Nc2nccc(C(F)(F)F)n2)cc(-c2cnc([C@@]3(O)CCCC(C)(C)C3)s2)c1.O=C(O)O

nearest known ligand 0.75

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 1)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.75

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
Bicarbonate SCHEMBL18203153 1.00 SYK (0.75) SYK
Bicarbonate SCHEMBL18203149 0.91 SYK (0.75) SYK
SCHEMBL2499724 0.90 SYK (0.85) SYK
Bicarbonate SCHEMBL18203145 0.90 SYK (0.73) SYK
Bicarbonate SCHEMBL18203143 0.90 SYK (0.78) SYK
SCHEMBL2497297 0.90 SYK (0.71) SYK
SCHEMBL2502756 0.90 SYK (0.71) SYK
SCHEMBL2502758 0.90 SYK (0.71) SYK
Bicarbonate SCHEMBL18203157 0.90 SYK (0.78) SYK
SCHEMBL2497293 0.90 SYK (0.71) SYK

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-2513098-B1 AMINOPYRIMIDINES AS SYK INHIBITORS MERCK SHARP & DOHME (US) 2016-11-09 EP claimed