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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.94 |
| ▸ | RAB9A | P51151 | 6/20 | 0.94 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.94 |
| ▸ | HPGD | P15428 | 2/20 | 0.94 |
| ▸ | TP53 | P04637 | 1/20 | 0.94 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.94 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.94 |
| ▸ | RELA | Q04206 | 1/20 | 0.94 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.74 |
| ▸ | HTT | P42858 | 1/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.64 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.62 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL4200989 | 0.97 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL8037431 | 0.97 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL2601942 | 0.84 | NPC1 (0.76) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL1599461 | 0.84 | NPC1 (0.76) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL108104 | 0.84 | NPC1 (0.76) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL21489895 | 0.83 | NPC1 (0.76) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL19710461 | 0.83 | NPC1 (0.76) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL5330501 | 0.83 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL20404239 | 0.82 | NPC1 (0.73) | NPC1RAB9ASMN1; SMN2HPGDTP53 | |
| SCHEMBL2260433 | 0.79 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2HPGDTP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1616859-B1 | Substituted cyclohexyl carboxylic acid compounds | SEIKAGAKU KOGYO CO LTD (JP) | 2013-09-04 | — | — | EP | claimed |