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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GABRP | O00591 | 2/20 | 0.33 |
| ▸ | GABRD | O14764 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.33 |
| ▸ | GABRE | P78334 | 2/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.33 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.33 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 SCHEMBL23649654 | 0.96 | GABRP (0.35) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL23649809 | 0.92 | NOS3 (0.34) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29672604 | 0.75 | NOS3 (0.33) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL22401216 | 0.75 | NOS3 (0.33) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL23666784 | 0.67 | HPGD (0.33) | HPGD | |
| SCHEMBL12682544 | 0.62 | KDM4E (0.36) | KDM4EALDH1A1PLAUGAANOS3 | |
| SCHEMBL559359 | 0.62 | NOS3 (0.52) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL1733718 | 0.61 | ALDH1A1 (0.47) | KDM4EHSD17B10MAPK1ALDH1A1LMNA | |
| SCHEMBL10431849 | 0.60 | MELK (0.36) | KDM4EHSD17B10TSHRMAPK1ALDH1A1 | |
| SCHEMBL24796779 | 0.60 | NOS3 (0.37) | KDM4EHSD17B10TSHRALDH1A1MAPT |
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-4090663-A1 | MAP4K1 INHIBITORS | Blueprint Medicines Corporation (US) | 2022-11-23 | — | — | EP | disclosed |
| WO-2021146370-A1 | MAP4K1 INHIBITORS | BLUEPRINT MEDICINES CORPORATION (US) | 2021-07-22 | — | — | WO | disclosed |