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 | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | LPL | P06858 | 1/20 | 0.44 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL158406 | 0.94 | TP53 (0.48) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL36295 | 0.80 | TP53 (0.67) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL2776957 | 0.78 | TP53 (0.56) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL1702558 | 0.78 | TP53 (0.56) | TP53TAAR1CYP2A6LPLLIPG | |
| Dimethylformamide SCHEMBL175327 | 0.78 | HPGD (0.38) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL7542835 | 0.77 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL28166306 | 0.77 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL31498555 | 0.77 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL27339836 | 0.77 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| Hydrogen Sulfide SCHEMBL29290777 | 0.77 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG |
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 |
|---|---|---|---|---|---|---|---|
| JP-2001226312-A | METHOD FOR PRODUCING 3-PHENYLPROPYL KETONE COMPOUND | UBE IND LTD | 2001-08-21 | — | — | JP | disclosed |