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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 2/20 | 0.51 |
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.51 |
| ▸ | CHRM3 known ✓ | P20309 | 2/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | AGXT | P21549 | 1/20 | 0.46 |
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 SCHEMBL11099360 | 0.88 | CHRM2 (0.52) | TAAR1CHRM2CHRM1CHRM3ABCB1 | |
| Hydrochloric Acid SCHEMBL5248234 | 0.84 | TAAR1 (0.56) | TAAR1CHRM2CHRM1CHRM3ABCB1 | |
| Bromide SCHEMBL10692126 | 0.83 | FDFT1 (0.48) | — | |
| SCHEMBL31208272 | 0.82 | TAAR1 (0.57) | TAAR1CHRM2CHRM1CHRM3ABCB1 | |
| Bromide SCHEMBL3110986 | 0.81 | TAAR1 (0.56) | TAAR1CHRM2CHRM1CHRM3ABCB1 | |
| SCHEMBL4060273 | 0.79 | TAAR1 (0.69) | TAAR1CHRM2CHRM1CHRM3ABCB1 | |
| Bromide SCHEMBL9442276 | 0.79 | CHRNA7 (0.49) | DRD2 | |
| Bromide SCHEMBL9954598 | 0.79 | LTA4H (0.52) | TAAR1ABCB1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL11228418 | 0.77 | HIF1A (0.64) | TAAR1MAOB | |
| SCHEMBL723511 | 0.77 | TAAR1 (0.77) | TAAR1CHRM2CHRM1CHRM3ABCB1 |
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-0034474-B1 | SUBSTITUTED IMIDAZOLES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Farmos-Yhtyma Oy (FI) | 1983-01-26 | — | — | EP | disclosed |
| US-4333947-A | HYPOTENSIVE AGENTS, BACTERICIDES, FUNGICIDES | FARMOS-YHTYMA OY (FI) | 1982-06-08 | — | — | US | disclosed |
| EP-0034474-A1 | Substituted imidazoles, their preparation and pharmaceutical compositions containing the same | Farmos-Yhtyma Oy (FI) | 1981-08-26 | — | — | EP | disclosed |