Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8414479 | 0.79 | BCHE (0.38) | IDO1TDO2PRCPBCHEACHE | |
| SCHEMBL8416176 | 0.76 | IDO1 (0.38) | IDO1TDO2PRCPBCHEACHE | |
| Hydrochloric Acid SCHEMBL8853251 | 0.73 | ADRA2C (0.37) | — | |
| Hydrochloric Acid SCHEMBL6559815 | 0.69 | BCHE (0.31) | IDO1TDO2BCHEACHE | |
| SCHEMBL23704622 | 0.69 | BCHE (0.52) | IDO1TDO2PRCPBCHEACHE | |
| SCHEMBL8416138 | 0.69 | BCHE (0.52) | IDO1TDO2PRCPBCHEACHE | |
| SCHEMBL28225513 | 0.67 | BCHE (0.48) | IDO1TDO2PRCPBCHEACHE | |
| Hydrochloric Acid SCHEMBL7604175 | 0.64 | NPC1 (0.32) | — | |
| SCHEMBL29988938 | 0.64 | ALDH1A1 (0.41) | IDO1TDO2PRCPBCHEACHE | |
| SCHEMBL28142477 | 0.64 | BCHE (0.44) | IDO1TDO2PRCPBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5610247-A | Unbridged metallocenes of 9-substituted fluorenyl compounds and use thereof | PHILLIPS PETROLEUM COMPANY (US) | 1997-03-11 | — | — | US | claimed |
| EP-0627440-A1 | 9-Substituted fluorenyl compounds and the preparation and use of metallocenes thereof | PHILLIPS PETROLEUM COMPANY (US) | 1994-12-07 | — | — | EP | claimed |