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 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 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 SCHEMBL7076887 | 0.95 | CYP11B2 (0.43) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL29370486 | 0.95 | PTGS2 (0.46) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL319633 | 0.95 | PTGS2 (0.46) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL27420942 | 0.93 | PTGS2 (0.44) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| Lithium SCHEMBL29594699 | 0.93 | PTGS2 (0.44) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL27490724 | 0.93 | PTGS2 (0.44) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL8737400 | 0.93 | PTGS2 (0.44) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| Bromide SCHEMBL31108155 | 0.93 | PTGS2 (0.44) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| SCHEMBL27185377 | 0.93 | PTGS2 (0.48) | CYP11B2CYP11B1PTGS2MAOAMAOB | |
| Hydrochloric Acid SCHEMBL8319749 | 0.91 | PTGS2 (0.43) | CYP11B2CYP11B1PTGS2MAOAMAOB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6124410-A | Method for purification of alpha-olefins for polymerization use and method for production of poly-alpha-olefins | MITSUI CHEMICALS, INC. (JP) | 2000-09-26 | — | — | US | claimed |
| EP-0683147-B1 | Method for purification of alpha-olefins for polymerization use and method for production of poly-alpha-olefins | MITSUI CHEMICALS INC (JP) | 1998-07-01 | — | — | EP | claimed |
| CN-1113890-C | Heterocyclic metallocenes and polymerization catalysts | MONTELL TECHNOLOGY COMPANY BV (NL) | 2003-07-09 | — | — | CN | disclosed |
| CN-1244201-A | Heterocyclic metallocenes and polymerization catalysts | MONTELL TECHNOLOGY COMPANY BV (NL) | 2000-02-09 | — | — | CN | disclosed |
| EP-0938491-A1 | HETEROCYCLIC METALLOCENES AND POLYMERIZATION CATALYSTS | Montell Technology Company B.V. (NL) | 1999-09-01 | — | — | EP | disclosed |
| WO-1998022486-A1 | HETEROCYCLIC METALLOCENES AND POLYMERIZATION CATALYSTS | MONTELL TECHNOLOGY COMPANY B.V. (NL) | 1998-05-28 | — | — | WO | disclosed |