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 | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.66 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.51 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | RARB | P10826 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12288978 | 0.91 | RAB9A (0.61) | RAB9ACRBNCYP2C9HRH3NPC1 | |
| SCHEMBL27262830 | 0.91 | RAB9A (0.60) | RAB9ATP53TSHRNPC1L3MBTL1 | |
| SCHEMBL9155376 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL9407190 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL9407194 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL8533565 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL8536494 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL10334220 | 0.87 | S1PR5 (0.62) | RAB9ATP53TSHRPLA2G4BRARB | |
| SCHEMBL11831277 | 0.87 | HRH3 (0.63) | RAB9ACRBNCYP2C9HRH3MEN1 | |
| SCHEMBL16307340 | 0.86 | NR5A1 (0.58) | RAB9ATP53TSHRPLA2G4BCRBN |
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-1597228-A2 | SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS | Sanofi-Aventis Deutschland GmbH (DE) | 2005-11-23 | — | — | EP | disclosed |
| WO-2004072025-A2 | SUBSTITUTED N-ARYLHETEROCYCLES, METHOD FOR PRODUCTION AND USE THEREOF AS MEDICAMENTS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2004-08-26 | — | — | WO | disclosed |