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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8206933 | 0.92 | LMNA (0.57) | KDM4ELMNAPOLBMEN1KMT2A | |
| Bicarbonate SCHEMBL7881463 | 0.89 | ALDH1A1 (0.53) | POLBMEN1KMT2AALDH1A1MAPT | |
| Bicarbonate SCHEMBL7890878 | 0.88 | POLB (0.51) | POLBMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL8211919 | 0.88 | KDM4E (0.54) | KDM4ELMNAPOLBMEN1KMT2A | |
| Bicarbonate SCHEMBL7425129 | 0.87 | MAPK1 (0.50) | LMNAPOLBMEN1KMT2AALDH2 | |
| Bicarbonate SCHEMBL7892996 | 0.85 | HPGD (0.50) | MEN1KMT2AALDH1A1MAPTRAB9A | |
| Bicarbonate SCHEMBL7427368 | 0.84 | SMN1; SMN2 (0.45) | KDM4EPOLBMEN1KMT2AALDH1A1 | |
| Bicarbonate SCHEMBL7881448 | 0.82 | KMT2A (0.46) | KDM4ELMNAPOLBMEN1KMT2A | |
| SCHEMBL8199987 | 0.81 | LMNA (0.57) | KDM4ELMNAPOLBMEN1KMT2A | |
| Bicarbonate SCHEMBL7889433 | 0.81 | TSHR (0.45) | LMNAMEN1KMT2ARAB9ANPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0934301-B1 | AMINOTHIOPHENE CARBOXYLIC ACID AMIDES AND THE USE THEREOF AS PHOSPHODIESTERASE INHIBITORS | MERCK PATENT GMBH (DE) | 2001-06-20 | — | — | EP | disclosed |
| EP-0934301-A1 | AMINOTHIOPHENE CARBOXYLIC ACID AMIDES AND THE USE THEREOF AS PHOSPHODIESTERASE INHIBITORS | MERCK PATENT GmbH (DE) | 1999-08-11 | — | — | EP | disclosed |
| WO-1998016521-A1 | AMINOTHIOPHENE CARBOXYLIC ACID AMIDES AND THE USE THEREOF AS PHOSPHODIESTERASE INHIBITORS | MERCK PATENT GMBH (DE) | 1998-04-23 | — | — | WO | disclosed |