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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NSD2 | O96028 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27617898 | 0.91 | ESR1 (0.34) | NSD2KMT2A | |
| SCHEMBL27636685 | 0.89 | AURKA (0.31) | NSD2BRD4 | |
| SCHEMBL27617731 | 0.86 | RORC (0.32) | KMT2A | |
| SCHEMBL27636779 | 0.84 | PSEN1 (0.32) | NSD2 | |
| SCHEMBL27617653 | 0.82 | AURKA (0.31) | NSD2BRD4 | |
| SCHEMBL27617633 | 0.81 | HSD11B1 (0.32) | HSD11B1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27617662 | 0.81 | NSD2 (0.34) | NSD2ALDH1A1SMN1; SMN2BRD4 | |
| SCHEMBL27617668 | 0.78 | GPR3 (0.40) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL27617590 | 0.78 | GPR3 (0.35) | ALDH1A1KMT2A | |
| SCHEMBL27617589 | 0.76 | GPR3 (0.37) | ALDH1A1KMT2AATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-101142235-A | Estrogen receptor structures | WYETH CORP (US) | 2008-03-12 | — | — | CN | disclosed |