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 | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
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 SCHEMBL7624529 | 0.88 | TAS1R3 (0.43) | EPHX2MEN1KMT2ARXFP1HPGD | |
| Bicarbonate SCHEMBL6995801 | 0.87 | EPHX2 (0.57) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL7000575 | 0.86 | EPHX2 (0.59) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL6998472 | 0.86 | EPHX2 (0.59) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL6990178 | 0.86 | NPC1 (0.43) | MEN1KMT2ASMN1; SMN2L3MBTL1HPGD | |
| Bicarbonate SCHEMBL6998215 | 0.85 | MEN1 (0.57) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL6989679 | 0.85 | GAA (0.51) | EPHX2MEN1KMT2ASMN1; SMN2SIGMAR1 | |
| Bicarbonate SCHEMBL6996297 | 0.84 | SIGMAR1 (0.40) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL7000560 | 0.79 | EPHX2 (0.44) | EPHX2MEN1KMT2ACYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL6991031 | 0.78 | KMT2A (0.50) | EPHX2MEN1KMT2ACYP1A2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0754175-B1 | ALKOXY-ALKYL-SUBSTITUTED 1-H-3-ARYL-PYRROLIDINE-2,4-DIONES USED AS HERBICIDES AND PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2003-01-29 | — | — | EP | disclosed |
| WO-1995026954-A1 | ALKOXY-ALKYL-SUBSTITUTED 1-H-3-ARYL-PYRROLIDINE-2,4-DIONES USED AS HERBICIDES AND PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1995-10-12 | — | — | WO | disclosed |