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 | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 7/20 | 0.53 |
| ▸ | TAS1R1 | Q7RTX1 | 7/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.51 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL7614072 | 0.86 | TAS1R3 (0.58) | TAS1R3TAS1R1MEN1KMT2ATAS1R2 | |
| Bicarbonate SCHEMBL4424429 | 0.86 | MEN1 (0.70) | MEN1KMT2AALDH1A1HPGDNPC1 | |
| Bicarbonate SCHEMBL4423971 | 0.85 | KMT2A (0.72) | MEN1KMT2AALDH1A1HPGDNPC1 | |
| Bicarbonate SCHEMBL4421862 | 0.85 | KMT2A (0.72) | MEN1KMT2AALDH1A1HPGDNPC1 | |
| Bicarbonate SCHEMBL8555858 | 0.85 | TAS1R3 (0.54) | TAS1R3TAS1R1MEN1KMT2ATAS1R2 | |
| Bicarbonate SCHEMBL4435145 | 0.82 | ALDH1A1 (0.62) | TAS1R3TAS1R1MEN1KMT2ATAS1R2 | |
| Bicarbonate SCHEMBL4428121 | 0.81 | GAA (0.66) | TAS1R3TAS1R1MEN1KMT2ATAS1R2 | |
| Bicarbonate SCHEMBL4435470 | 0.81 | MEN1 (0.51) | MEN1KMT2AHPGDNPC1LMNA | |
| Bicarbonate SCHEMBL4433274 | 0.80 | MEN1 (0.56) | MEN1KMT2AHPGDNPC1LMNA | |
| Bicarbonate SCHEMBL4421056 | 0.78 | MEN1 (0.56) | MEN1KMT2AHPGDNPC1LMNA |
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-0741700-B1 | 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS | BAYER CROPSCIENCE AG (DE) | 2009-10-07 | — | — | EP | disclosed |
| EP-0741700-A1 | 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS | BAYER AG (DE) | 1996-11-13 | — | — | EP | disclosed |
| WO-1995020572-A1 | 1-H-3-ARYLPYRROLIDINE-2,4-DIONE DERIVATIVES AS PEST-CONTROL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1995-08-03 | — | — | WO | disclosed |