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 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.31 |
| ▸ | FGFR2 | P21802 | 3/20 | 0.31 |
| ▸ | FGFR4 | P22455 | 3/20 | 0.31 |
| ▸ | FGFR3 | P22607 | 3/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | STAT3 | P40763 | 1/20 | 0.30 |
| ▸ | STAT1 | P42224 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27910961 | 0.93 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL10900576 | 0.71 | MAOA (0.36) | — | |
| SCHEMBL31658228 | 0.70 | ALDH1A1 (0.34) | ALDH1A1HPGDNFKB1NFKB2RELA | |
| SCHEMBL28829617 | 0.69 | MAOA (0.36) | — | |
| SCHEMBL29196481 | 0.67 | — | — | |
| SCHEMBL27566453 | 0.67 | — | — | |
| SCHEMBL27938964 | 0.67 | — | — | |
| Terephthalamide SCHEMBL27579267 | 0.67 | PARP10 (0.41) | ALDH1A1FGFR1FGFR2FGFR4FGFR3 | |
| Phenol SCHEMBL25279130 | 0.67 | CA12 (0.37) | — | |
| SCHEMBL1501865 | 0.65 | CDC25B (0.41) | ALDH1A1HSP90AA1HSP90AB1HPGD |
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-102552106-A | Steroid intraocular implants with extended sustained release over 2 months | ALLERGAN INC | 2012-07-11 | — | — | CN | disclosed |