Bicarbonate

Bicarbonate

SCHEMBL9628164

C=C[Si](CC)(CC)CC.O=C(O)O

nearest known ligand 0.38

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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 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
FFAR3 O14843 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL202800 0.85
SCHEMBL6516287 0.82 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL28435327 0.70 TDP1 (0.45) ALDH1A1TSHRFFAR3TDP1
Bicarbonate SCHEMBL9628099 0.69 LMNA (0.41) ALDH1A1TSHRFFAR3LMNA
Bicarbonate SCHEMBL995845 0.69
Bicarbonate SCHEMBL7091018 0.69 ALDH1A1 (0.45) ALDH1A1TSHRFFAR3TDP1LMNA
Bicarbonate SCHEMBL27811383 0.69 ALDH1A1 (0.45) ALDH1A1TSHRFFAR3TDP1LMNA
SCHEMBL7770882 0.69 LMNA (0.35) ALDH1A1TSHRLMNA
SCHEMBL11481556 0.69 TSHR (0.32) TSHR
Bicarbonate SCHEMBL6423684 0.67

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5158854-A Ladder polymers having hydrophilic groups NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1992-10-27 US claimed
EP-0232167-B1 PHOTOSENSITIVE AND HIGH ENERGY BEAM SENSITIVE RESIN COMPOSITION CONTAINING SUBSTITUTED POLYSILOXANE NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1988-12-28 EP claimed