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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.42 |
| ▸ | TACR1 known ✓ | P25103 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5828995 | 0.96 | SLC6A2 (0.42) | CYP19A1SLC6A2SLC6A4HIF1AALDH1A1 | |
| Bromide SCHEMBL6442757 | 0.81 | HIF1A (0.40) | SLC6A2SLC6A4HIF1AALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9292231 | 0.80 | HIF1A (0.55) | SLC6A2SLC6A4HIF1AALDH1A1SNCA | |
| Bromide SCHEMBL4179333 | 0.78 | HIF1A (0.40) | HIF1AALDH1A1SNCATSHRMAOB | |
| Bromide SCHEMBL2446627 | 0.75 | HIF1A (0.55) | SLC6A2SLC6A4HIF1AALDH1A1SNCA | |
| Hydrochloric Acid SCHEMBL10418821 | 0.74 | SNCA (0.41) | HIF1AALDH1A1SMN1; SMN2SNCATSHR | |
| SCHEMBL7382769 | 0.73 | CYP1A2 (0.50) | SLC6A2SLC6A4TSHRFFAR1MAOB | |
| SCHEMBL2659054 | 0.71 | GABRA1 (0.47) | CYP19A1SLC6A2SLC6A4ALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2450028 | 0.71 | HIF1A (0.44) | CYP19A1SLC6A2SLC6A4HIF1AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11062554 | 0.71 | HIF1A (0.44) | HIF1AALDH1A1SNCATSHRNPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1138718-A1 | AQUEOUS COMPOSITION FOR VULCANIZATION OF FLUORO RUBBER AND ARTICLE COATED WITH FLUORO RUBBER | Daikin Industries, Ltd. (JP) | 2001-10-04 | — | — | EP | disclosed |
| US-5166210-A | QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1992-11-24 | — | — | US | disclosed |
| US-5028615-A | Treatment of hypersensitivity | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1991-07-02 | — | — | US | disclosed |
| US-4980486-A | Phenyl isothiocyanates | HOFFMANN-LA ROCHE INC. (US) | 1990-12-25 | — | — | US | disclosed |
| US-4920133-A | Quinoline derivatives and use thereof as antagonists of leukotriene D4 | RORER PHARMACEUTICAL CORP. (US) | 1990-04-24 | — | — | US | disclosed |