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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL3847311 | 1.00 | ALDH1A1 (0.62) | ALDH1A1LMNAHPGDRAB9APOLB | |
| Bicarbonate SCHEMBL3847308 | 0.96 | ALDH1A1 (0.64) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL1950061 | 0.95 | ALDH1A1 (0.68) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL19709040 | 0.71 | HPGD (0.97) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL13069659 | 0.71 | RAB9A (0.69) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL1952477 | 0.71 | ALDH1A1 (0.75) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL27612831 | 0.71 | RAB9A (0.47) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL8284320 | 0.70 | RAB9A (0.72) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL19705176 | 0.70 | HPGD (1.00) | ALDH1A1LMNAHPGDRAB9APOLB | |
| SCHEMBL10064244 | 0.70 | MEN1 (0.83) | ALDH1A1LMNAHPGDRAB9APOLB |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2099447-A1 | IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS | Incyte Corporation (US) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008064157-A1 | IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS | INCYTE CORPORATION (US) | 2008-05-29 | — | — | WO | disclosed |