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 | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 13/20 | 0.41 |
| ▸ | NPC1 | O15118 | 12/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | PKM | P14618 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
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 SCHEMBL7065269 | 0.81 | RAB9A (0.42) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| Hydrochloric Acid SCHEMBL7062188 | 0.79 | RAB9A (0.41) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| SCHEMBL7062192 | 0.75 | RAB9A (0.38) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| SCHEMBL7064946 | 0.75 | RAB9A (0.37) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| SCHEMBL7065272 | 0.75 | RAB9A (0.39) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| Hydrochloric Acid SCHEMBL7061664 | 0.75 | KDM4E (0.42) | RAB9ANPC1CYP1A2ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL394239 | 0.71 | CYP11B1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL10653147 | 0.67 | RAB9A (0.65) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| Hydrochloric Acid SCHEMBL2415958 | 0.67 | RAB9A (0.65) | RAB9ANPC1CYP3A4ARCYP1A2 | |
| Hydrochloric Acid SCHEMBL394872 | 0.67 | CYP19A1 (0.31) | RAB9ANPC1ALDH1A1KDM4ESMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6635733-B2 | Coordination catalyst; radiation transparent, elasticity | CHISSO CORPORATION (JP) | 2003-10-21 | — | — | US | disclosed |
| US-6479646-B1 | Metallocene compounds having indenyl ligand and catalysts for olefin polymerization containing the same | CHISSO CORPORATION (JP) | 2002-11-12 | — | — | US | disclosed |
| US-20020002261-A1 | Elastomeric polypropylene | JNC PETROCHEMICAL CORPORATION (JP) | 2002-01-03 | — | — | US | disclosed |
| US-20010031834-A1 | Using coordination catalyst; flexibility, elasticity; molding materials | CHISSO CORPORATION | 2001-10-18 | — | — | US | disclosed |