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 | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | EDNRA | P25101 | 2/20 | 0.45 |
| ▸ | EDNRB | P24530 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12188964 | 0.91 | MAOB (0.50) | MEN1RAB9AKMT2ACA1CA2 | |
| SCHEMBL13888944 | 0.91 | MAOB (0.50) | MEN1RAB9AKMT2ACA1CA2 | |
| SCHEMBL31414038 | 0.81 | MEN1 (0.49) | MEN1RAB9AKMT2ACA1CA2 | |
| Bicarbonate SCHEMBL10976674 | 0.80 | KDM1A (0.54) | MEN1KMT2ALMNATSHRCYP2C9 | |
| Bicarbonate SCHEMBL10984022 | 0.79 | KDM1A (0.57) | MAOBMAOAKDM1A | |
| Bicarbonate SCHEMBL10971534 | 0.78 | MAPK1 (0.50) | MEN1KMT2ALMNATSHRCYP2C9 | |
| SCHEMBL29776873 | 0.77 | MEN1 (0.46) | MEN1RAB9AKMT2ACA1CA2 | |
| SCHEMBL28524760 | 0.76 | RAB9A (0.48) | MEN1RAB9AKMT2ACA1CA2 | |
| SCHEMBL11520481 | 0.76 | MEN1 (0.45) | MEN1RAB9AKMT2ACA1CA2 | |
| SCHEMBL7070199 | 0.76 | KMT2A (0.45) | MEN1RAB9AKMT2ACA1CA2 |
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-0095696-B1 | PROCESS FOR THE PREPARATION OF 2,2-DIMETHYL-3-ARYL-CYCLOPROPANE CARBOXYLIC ACIDS AND THEIR ESTERS, INTERMEDIATE PRODUCTS THEREFOR AND PROCESSES FOR THEIR PREPARATION | BAYER AG (DE) | 1985-04-10 | — | — | EP | disclosed |
| EP-0095696-A1 | Process for the preparation of 2,2-dimethyl-3-aryl-cyclopropane carboxylic acids and their esters, intermediate products therefor and processes for their preparation | BAYER AG (DE) | 1983-12-07 | — | — | EP | disclosed |