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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.51 |
| ▸ | MET | P08581 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | PLK1 | P53350 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29473917 | 0.92 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL114725 | 0.92 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL20309118 | 0.92 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| Methane SCHEMBL28862287 | 0.91 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL28325532 | 0.83 | ALDH1A1 (0.46) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL1492942 | 0.82 | AKR1C3 (0.70) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL2341919 | 0.82 | AKR1C3 (0.70) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL18948481 | 0.82 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL30564458 | 0.82 | AKR1C3 (0.70) | ALDH1A1LMNASMN1; SMN2AKR1C3AKR1C2 | |
| SCHEMBL12386875 | 0.81 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2METALOX15 |
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-109568166-A | Fragrance material | 宝洁公司 | 2019-04-05 | — | — | CN | disclosed |