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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.37 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.30 |
| ▸ | GPR3 | P46089 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.36 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.32 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
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 SCHEMBL4880315 | 0.69 | GPR3 (0.44) | GPR3SLC22A2SLC22A3 | |
| SCHEMBL31355086 | 0.64 | SPHK1 (0.44) | GPR3BCHEACHEKDM4EALDH1A1 | |
| SCHEMBL4476575 | 0.61 | PTGS2 (0.56) | GPR3BCHEACHEPTGS2 | |
| Phosphine SCHEMBL2085257 | 0.60 | PTGS2 (0.54) | BCHEACHEPTGS2 | |
| SCHEMBL1509312 | 0.59 | GPR3 (1.00) | GPR3BCHEACHESLC22A2SLC22A3 | |
| SCHEMBL23704622 | 0.58 | BCHE (0.52) | BCHEACHEHTR2AHTR2CHTR2B | |
| SCHEMBL8416138 | 0.58 | BCHE (0.52) | BCHEACHEHTR2AHTR2CHTR2B | |
| SCHEMBL1477602 | 0.58 | GPR3 (0.64) | GPR3BCHEACHESLC22A2SLC22A3 | |
| SCHEMBL28709520 | 0.57 | GPR3 (0.95) | GPR3BCHEACHESLC22A2SLC22A3 | |
| Hydrochloric Acid SCHEMBL30854875 | 0.57 | GPR3 (0.40) | GPR3BCHEACHESLC22A2SLC22A3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1991004257-A1 | MONOCYCLOPENTADIENYL TRANSITION METAL OLEFIN POLYMERIZATION CATALYSTS | EXXON CHEMICAL PATENTS INC. (US) | 1991-04-04 | — | — | WO | disclosed |