Bicarbonate

Bicarbonate

SCHEMBL10604571

CCC1(CC)C(Cl)C1(Cl)Cl.O=C(O)O

nearest known ligand 0.30

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
▸ FFAR3 O14843 1/20 0.30

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
SCHEMBL9640365 0.73 — —
SCHEMBL11042255 0.65 FFAR3 (0.35) FFAR3
SCHEMBL10604385 0.65 APLNR (0.31) —
Bicarbonate SCHEMBL10867748 0.65 MAPK1 (0.33) FFAR3
SCHEMBL5509512 0.63 — —
Bicarbonate SCHEMBL9628771 0.61 MAPK1 (0.33) FFAR3
Bicarbonate SCHEMBL28280718 0.61 — —
Bicarbonate SCHEMBL9303939 0.61 FFAR3 (0.50) FFAR3
Bicarbonate SCHEMBL10865056 0.60 CA1 (0.36) FFAR3
Bicarbonate SCHEMBL10865371 0.60 MAPK1 (0.32) —

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-0170842-B1 N-BENZYLCYCLOPROPANECARBOXAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND FUNGICIDES FOR AGRICULTURE AND HORTICULTURE NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-09-13 — — EP disclosed
Send feedback