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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 3/20 | 0.52 |
| ▸ | RAC1 | P63000 | 6/20 | 0.70 |
| ▸ | CDC42 | P60953 | 5/20 | 0.70 |
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | BCHE | P06276 | 3/20 | 0.52 |
| ▸ | BLM | P54132 | 3/20 | 0.52 |
| ▸ | BAD | Q92934 | 3/20 | 0.52 |
| ▸ | GMNN | O75496 | 2/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.52 |
| ▸ | RAD52 | P43351 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9679427 | 0.99 | RAC1 (0.69) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8709312 | 0.95 | RAC1 (0.70) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL9679413 | 0.94 | RAC1 (0.69) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL9681626 | 0.92 | RAC1 (0.79) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL9679421 | 0.83 | RAC1 (0.56) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Fagaridine SCHEMBL6961260 | 0.82 | ALDH1A1 (0.78) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3321466 | 0.82 | RAC1 (1.00) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL424548 | 0.82 | RAD52 (0.67) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29546268 | 0.82 | RAD52 (0.67) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8312714 | 0.82 | RAC1 (0.55) | RAC1CDC42MAPTSMN1; SMN2ALDH1A1 |
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-5747502-A | ANTITUMOR AGENTS, ANTIGROWTH AGENTS AND ANTICARCINOGENIC AGENTS | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1998-05-05 | — | — | US | disclosed |
| EP-0487930-A1 | Process for preparing benzo[C]phenanthridinium derivatives, and novel compounds prepared by said process | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1992-06-03 | — | — | EP | disclosed |