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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | MAP3K9 | P80192 | 1/20 | 0.33 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
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 SCHEMBL17845923 | 0.76 | PNMT (0.46) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL8468716 | 0.75 | PNMT (0.49) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL7945059 | 0.73 | PNMT (0.40) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL22263591 | 0.73 | PNMT (0.57) | PNMTNPC1RAB9APGRALDH1A1 | |
| Tert-Butylamine SCHEMBL27542088 | 0.70 | PNMT (0.44) | PNMTNPC1RAB9APGRALDH1A1 | |
| Hydrochloric Acid SCHEMBL4742132 | 0.70 | PNMT (0.41) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL30103334 | 0.69 | PNMT (0.63) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL524602 | 0.69 | PNMT (0.63) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL27470292 | 0.68 | PNMT (0.49) | PNMTNPC1RAB9APGRALDH1A1 | |
| SCHEMBL30566335 | 0.68 | ALDH1A1 (0.52) | PNMTNPC1RAB9APGRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1311513-A1 | CATALYSTS | Borealis Technology Oy (FI) | 2003-05-21 | — | — | EP | disclosed |
| WO-2002016374-A1 | CATALYSTS | BOREALIS TECHNOLOGY OY (FI) | 2002-02-28 | — | — | WO | disclosed |