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 | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.36 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.36 |
| ▸ | IDH2 | P48735 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | UBE2M | P61081 | 1/20 | 0.35 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | SMO | Q99835 | 1/20 | 0.35 |
| ▸ | MLNR | O43193 | 2/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2133810 | 0.85 | HSPA9 (0.36) | HSPA9POLBRAB9AEPHX2UBE2M | |
| SCHEMBL2135559 | 0.84 | GRIN2B (0.38) | HSPA9POLBRAB9AEPHX2UBE2M | |
| Bicarbonate SCHEMBL16240210 | 0.80 | LMNA (0.37) | CCR5MALT1EPHX2SMOMLNR | |
| SCHEMBL2139566 | 0.78 | KDM1A (0.34) | HSPA9 | |
| SCHEMBL1420520 | 0.66 | MALT1 (0.66) | MALT1IDH2RAB9AEPHX2LMNA | |
| Bicarbonate SCHEMBL16239859 | 0.65 | ATM (0.37) | CCR5 | |
| SCHEMBL2138673 | 0.65 | LMNA (0.37) | BRD4EPHX2LMNAGRIN2B | |
| SCHEMBL2138497 | 0.65 | HSPA9 (0.39) | HSPA9BRD4EPHX2GRM5LMNA | |
| SCHEMBL24513148 | 0.65 | ADRA2A (0.56) | MALT1IDH2CRHR1POLBRAB9A | |
| Hydrochloric Acid SCHEMBL1669945 | 0.64 | MALT1 (0.64) | MALT1IDH2RAB9AEPHX2LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2630124-B1 | TETRAHYDROQUINOLINE DERIVATIVES USED AS AMPK ACTIVATORS | HOFFMANN LA ROCHE (CH) | 2014-11-19 | — | — | EP | claimed |