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 | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.74 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.41 |
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 SCHEMBL7615138 | 0.92 | ALDH1A1 (0.66) | KMT2ASIGMAR1ALDH1A1LMNAP2RX7 | |
| Bicarbonate SCHEMBL4431534 | 0.90 | KMT2A (0.59) | KMT2ASIGMAR1ALDH1A1LMNAMEN1 | |
| Bicarbonate SCHEMBL7612864 | 0.85 | KMT2A (0.80) | KMT2ASIGMAR1ALDH1A1LMNAAKR1B1 | |
| Bicarbonate SCHEMBL7619296 | 0.83 | KMT2A (0.76) | KMT2ASIGMAR1ALDH1A1LMNAAKR1B1 | |
| Bicarbonate SCHEMBL7615605 | 0.82 | KMT2A (0.74) | KMT2ASIGMAR1ALDH1A1LMNAAKR1B1 | |
| Bicarbonate SCHEMBL7619163 | 0.80 | KMT2A (0.76) | KMT2ASIGMAR1ALDH1A1LMNAAKR1B1 | |
| Bicarbonate SCHEMBL7620879 | 0.80 | SIGMAR1 (0.60) | KMT2ASIGMAR1ALDH1A1LMNAP2RX7 | |
| SCHEMBL16543116 | 0.79 | EPHX2 (0.65) | KMT2ASIGMAR1ALDH1A1LMNAEPHX1 | |
| Bicarbonate SCHEMBL7615814 | 0.79 | KMT2A (0.69) | KMT2ASIGMAR1ALDH1A1LMNAAKR1B1 | |
| Bicarbonate SCHEMBL8559853 | 0.79 | SIGMAR1 (0.47) | KMT2ASIGMAR1LMNAEPHX1ALPL |
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-0596298-B1 | 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides | BAYER AG (DE) | 2002-01-09 | — | — | EP | disclosed |
| EP-0596298-A2 | 5-Spirosubstituted 1-H-3-aryl-pyrrolidin-2,4-dione derivatives as herbicides, insecticides and acaricides | BAYER AG (DE) | 1994-05-11 | — | — | EP | disclosed |