Known targets — ChEMBL curated mechanism
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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 4/20 | 0.48 |
| ▸ | TAS2R14 | Q9NYV8 | 5/20 | 0.47 |
| ▸ | HTR2A | P28223 | 4/20 | 0.44 |
| ▸ | HTR2C | P28335 | 4/20 | 0.44 |
| ▸ | HTR7 | P34969 | 4/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8524504 | 0.88 | TAS2R14 (0.57) | TAS2R14CNR2LMNA | |
| SCHEMBL27561328 | 0.88 | TAS2R14 (0.57) | TAS2R14CNR2LMNA | |
| SCHEMBL27485384 | 0.85 | TAS2R14 (0.48) | TAS2R14CNR2LMNAPOLB | |
| SCHEMBL8524401 | 0.85 | TAS2R14 (0.48) | TAS2R14CNR2LMNAPOLB | |
| SCHEMBL27729713 | 0.77 | MMP3 (0.57) | PTGESTAS2R14HTR2AHTR2CHTR7 | |
| SCHEMBL16558052 | 0.77 | MAPK1 (0.51) | ALDH1A1NPSR1NR1D1POLB | |
| SCHEMBL6434196 | 0.76 | PLAU (0.58) | PTGESTAS2R14CNR2MMP3LMNA | |
| SCHEMBL6434861 | 0.74 | PLAU (0.59) | PTGESTAS2R14CNR2MMP3NR1D1 | |
| SCHEMBL3482958 | 0.73 | PTGES (0.53) | PTGESTAS2R14HTR2AHTR2CHTR7 | |
| SCHEMBL1133773 | 0.73 | LMNA (0.59) | PTGESMMP3HTTNR1D1LMNA |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996020173-A1 | PIPERAZINE DERIVATIVES, MEDICAMENTS CONTAINING THE SAME, THEIR USE AND PROCESS FOR PREPARING THE SAME | DR. KARL THOMAE GMBH (DE) | 1996-07-04 | — | — | WO | disclosed |