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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
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 SCHEMBL6990352 | 0.88 | MEN1 (0.52) | MEN1KMT2ASIGMAR1GAAKDM4E | |
| Bicarbonate SCHEMBL4432364 | 0.87 | MEN1 (0.57) | MEN1KMT2ASIGMAR1GAAKDM4E | |
| Bicarbonate SCHEMBL7615566 | 0.86 | SIGMAR1 (0.56) | KMT2ASIGMAR1ALDH1A1 | |
| Bicarbonate SCHEMBL4425148 | 0.86 | MEN1 (0.56) | MEN1KMT2ASIGMAR1GAAEPHX2 | |
| Bicarbonate SCHEMBL8554980 | 0.85 | SIGMAR1 (0.44) | KMT2ASIGMAR1GAA | |
| Bicarbonate SCHEMBL4428400 | 0.85 | MEN1 (0.70) | MEN1KMT2ASIGMAR1EPHX2HPGD | |
| Bicarbonate SCHEMBL4428116 | 0.84 | MEN1 (0.56) | MEN1KMT2ASIGMAR1GAAKDM4E | |
| Bicarbonate SCHEMBL4433306 | 0.84 | MEN1 (0.56) | MEN1KMT2ASIGMAR1GAAKDM4E | |
| Bicarbonate SCHEMBL4428096 | 0.84 | KMT2A (0.72) | MEN1KMT2ASIGMAR1EPHX2ALDH1A1 | |
| Bicarbonate SCHEMBL4434715 | 0.84 | KMT2A (0.72) | MEN1KMT2ASIGMAR1EPHX2ALDH1A1 |
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 |