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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
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 SCHEMBL9525276 | 0.93 | MEN1 (0.38) | SMN1; SMN2KDM4EMAPTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9525058 | 0.92 | SPHK1 (0.39) | KDM4ETRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9525965 | 0.90 | KDM4E (0.39) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9525660 | 0.88 | KDM4E (0.39) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9524577 | 0.87 | KDM4E (0.38) | SMN1; SMN2KDM4EMAPTCTSKMEN1 | |
| Iodide SCHEMBL9407506 | 0.85 | MAPT (0.39) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9525940 | 0.83 | ALDH1A1 (0.38) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9524118 | 0.80 | ALDH1A1 (0.39) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9524285 | 0.80 | KDM4E (0.41) | SMN1; SMN2KDM4EMAPTTRPV1CTSK | |
| Hydrochloric Acid SCHEMBL9525744 | 0.79 | ALDH1A1 (0.44) | SMN1; SMN2KDM4EMAPTTRPV1MGLL |
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 |
|---|---|---|---|---|---|---|---|
| EP-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0301751-A1 | Pyridinium derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |