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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GALK1 | P51570 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL28529430 | 0.97 | ALDH1A1 (0.36) | ALDH1A1CYP2A6CA12CA1CA2 | |
| SCHEMBL28529021 | 0.92 | CA12 (0.33) | ALDH1A1CYP2A6CA12CA1CA2 | |
| SCHEMBL9249191 | 0.81 | ALDH1A1 (0.41) | ALDH1A1CYP2A6SLC6A4KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL4094244 | 0.81 | ALDH1A1 (0.35) | ALDH1A1CYP2A6CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL4068167 | 0.81 | ALDH1A1 (0.35) | ALDH1A1CYP2A6CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL4060835 | 0.81 | ALDH1A1 (0.35) | ALDH1A1CYP2A6CA12CA1CA2 | |
| SCHEMBL5860453 | 0.80 | ALDH1A1 (0.37) | ALDH1A1CYP2A6CA12CA1CA2 | |
| SCHEMBL17952999 | 0.80 | ALDH1A1 (0.37) | ALDH1A1CYP2A6CA12CA1CA2 | |
| SCHEMBL30229819 | 0.80 | ALDH1A1 (0.37) | ALDH1A1CYP2A6CA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL5167142 | 0.80 | DHFR (0.35) | ALDH1A1CYP2A6CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112424210-B | Novel transition metal compound and method for producing polypropylene using same | 株式会社LG化学 | 2024-01-09 | — | — | CN | disclosed |
| CN-112424210-A | Novel transition metal compound and method for producing polypropylene using same | 株式会社LG化学 | 2021-02-26 | — | — | CN | disclosed |