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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 7/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 SCHEMBL9523792 | 0.91 | SMN1; SMN2 (0.36) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL9526212 | 0.85 | SMN1; SMN2 (0.39) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL10401163 | 0.83 | ALDH1A1 (0.34) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| Iodide SCHEMBL9407503 | 0.82 | KMT2A (0.34) | LMNAALDH1A1ADRB2HDAC1HDAC6 | |
| Hydrochloric Acid SCHEMBL9525961 | 0.82 | CHRNB2 (0.42) | HDAC1HDAC6CHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL9525652 | 0.82 | ALDH1A1 (0.36) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL9525253 | 0.82 | MEN1 (0.33) | ALDH1A1ADRB2HDAC1HDAC6KMT2A | |
| Hydrochloric Acid SCHEMBL9525722 | 0.81 | NPSR1 (0.42) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL9528195 | 0.81 | TSHR (0.30) | NPSR1 | |
| Hydrochloric Acid SCHEMBL9524572 | 0.81 | ALDH1A1 (0.35) | NPC1RAB9ASMN1; SMN2ALDH1A1ADRB2 |
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 |