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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 20/20 | 0.65 |
| ▸ | HTR2A | P28223 | 17/20 | 0.65 |
| ▸ | HTR2B | P41595 | 17/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 12/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | GMNN | O75496 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8168881 | 0.99 | HTR2C (0.63) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| Hydrochloric Acid SCHEMBL7364926 | 0.96 | HTR2C (0.71) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| Hydrochloric Acid SCHEMBL7364934 | 0.89 | HTR2C (0.68) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7362463 | 0.83 | HTR2C (0.91) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7635338 | 0.79 | HTR2C (1.00) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7036900 | 0.76 | HTR2C (0.86) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7042431 | 0.75 | HTR2C (0.87) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7036391 | 0.73 | HTR2C (0.84) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7042693 | 0.73 | HTR2C (1.00) | HTR2CHTR2AHTR2BCYP1A2KDM4E | |
| SCHEMBL7039482 | 0.71 | HTR2C (1.00) | HTR2CHTR2AHTR2BCYP1A2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6028085-A | Indole derivatives as 5-HT receptor antagonist | SMITHKLINE BEECHAM PLC (GB) | 2000-02-22 | — | — | US | disclosed |
| EP-0891348-A1 | INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM PLC (GB) | 1999-01-20 | — | — | EP | disclosed |
| WO-1997037989-A1 | INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM PLC (GB) | 1997-10-16 | — | — | WO | disclosed |