Bicarbonate

Bicarbonate

SCHEMBL8973196

CN(C)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.CN(C)CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.O=C([O-])[O-]

nearest known ligand 0.52

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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 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.52
▸ CYP2C19 P33261 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2D6 P10635 2/20 0.52
▸ HTR2A P28223 3/20 0.48
▸ HRH1 P35367 3/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ RAB9A P51151 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ UBE2N P61088 1/20 0.42
▸ CHRM1 P11229 2/20 0.41
▸ UTS2R Q9UKP6 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
Oxalic Acid SCHEMBL9549804 0.95 TSHR (0.50) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Acetic Acid SCHEMBL9549770 0.95 TSHR (0.50) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Acetic Acid SCHEMBL9848332 0.93 TSHR (0.49) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Bromide SCHEMBL143506 0.87 HIF1A (0.58) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Iodide SCHEMBL9549744 0.87 HIF1A (0.58) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Water SCHEMBL8528580 0.87 HIF1A (0.58) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL9549567 0.87 HIF1A (0.58) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
SCHEMBL8532850 0.87 HIF1A (0.58) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
Phosphoric Acid SCHEMBL8972371 0.86 HTR2A (0.50) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6
SCHEMBL8972950 0.85 HIF1A (0.52) TSHRCYP2C19ALDH1A1CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1061998-C Process for producing aromatic polycarbonate MITSUBISHI CHEM CORP (JP) 2001-02-14 — — CN disclosed
US-5578694-A MELT POLYCONDENSATION OF AROMATIC DIOL AND DIARYL CARBONATE; ESTER INTERCHANGE USING PHOSPHONIUM CATALYST MITSUBISHI CHEMICAL CORPORATION (JP) 1996-11-26 — — US disclosed
CN-1127265-A Process for producing aromatic polycarbonate MITSUBISHI CHEM CORP (JP) 1996-07-24 — — CN disclosed
EP-0703262-A2 Process for producing aromatic polycarbonate Mitsubishi Chemical Corporation (JP) 1996-03-27 — — EP disclosed
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