Bicarbonate

Bicarbonate

SCHEMBL3955752

C=CC(=O)OCc1ccccc1.O=C(O)O

nearest known ligand 0.62

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 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.62
LMNA P02545 3/20 0.59
ALDH1A1 P00352 5/20 0.55
THRB P10828 1/20 0.54
AKR1B10 O60218 2/20 0.54
AKR1B1 P15121 2/20 0.54
CA12 O43570 2/20 0.54
CA9 Q16790 2/20 0.54
CA4 P22748 1/20 0.54
CA6 P23280 1/20 0.54
CA5A P35218 1/20 0.54
CA7 P43166 1/20 0.54
CA14 Q9ULX7 1/20 0.54
CA5B Q9Y2D0 1/20 0.54
TDP1 Q9NUW8 2/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
KMT2A Q03164 1/20 0.53

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
Benzene SCHEMBL28307095 0.98 HCAR2 (0.65) HCAR2LMNAALDH1A1THRBAKR1B10
SCHEMBL28230354 0.98 HCAR2 (0.65) HCAR2LMNAALDH1A1THRBAKR1B10
SCHEMBL34054 0.98 HCAR2 (0.65) HCAR2LMNAALDH1A1THRBAKR1B10
SCHEMBL11696680 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
Hydrochloric Acid SCHEMBL28804358 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
Ammonia Solution, Strong SCHEMBL11584311 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
Ethylene SCHEMBL6402744 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
SCHEMBL8767252 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
Methane SCHEMBL28851569 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10
Bromide SCHEMBL28618019 0.96 HCAR2 (0.62) HCAR2LMNAALDH1A1THRBAKR1B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498394-B2 (Meth)acrylic and (meth)acrylamide monomers, polymerizable compositions, and polymers obtained THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2009-03-03 US disclosed
US-20060252900-A1 (Meth)arcrylic and (meth)acrylamide monomers, polymerizable compositions, and polymers obtained REGENTS OF THE UNIVERSITY OF COLORADO, THE 2006-11-09 US disclosed
WO-2004077511-A2 (METH)ACRYLIC AND (METH)ACRYLAMIDE MONOMERS, POLYMERIZABLE COMPOSITIONS, AND POLYMERS OBTAINED THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2004-09-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060252900-A1 (Meth)arcrylic and (meth)acrylamide monomers, polymerizable compositions, and polymers obtained MMAB, MAT1A, MAT2A HCAR2 581/4885LMNA 4478/4885ALDH1A1 396/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.