Bicarbonate

Bicarbonate

SCHEMBL7202521

CN1CC=C(c2c[nH]c3ccc(CC(=O)c4cc(F)cc(F)c4F)cc23)CC1.O=C(O)O

nearest known ligand 0.60

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
SLC6A4 P31645 4/20 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
Acetic Acid SCHEMBL7207801 0.88 SLC6A4 (0.63) SLC6A4
SCHEMBL7201460 0.87 SLC6A4 (0.58) SLC6A4
SCHEMBL7207614 0.86 SLC6A4 (0.59) SLC6A4
SCHEMBL7206081 0.84 SLC6A4 (0.52) SLC6A4
SCHEMBL7200316 0.84 SLC6A4 (0.59) SLC6A4
SCHEMBL7209936 0.84 SLC6A4 (0.67) SLC6A4
SCHEMBL7204456 0.83 SLC6A4 (0.60) SLC6A4
SCHEMBL7201252 0.83 SLC6A4 (0.55) SLC6A4
SCHEMBL7199515 0.81 SLC6A4 (0.63) SLC6A4
SCHEMBL7205038 0.81 SLC6A4 (0.65) SLC6A4

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
US-6608079-B1 Activating serotonin-1F receptors, inhibiting neuronal protein extravasation, treating migraine ELI LILLY AND COMPANY 2003-08-19 US disclosed