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 | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28857734 | 0.79 | CA1 (0.44) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL2957161 | 0.78 | HPGD (0.48) | CA1CA2CA9ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL9573666 | 0.77 | CA1 (0.40) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL223100 | 0.74 | CA1 (0.41) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL29418937 | 0.74 | CA1 (0.41) | CA1CA2CA9ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL27453653 | 0.74 | TDP1 (0.42) | CA2ALDH1A1HSD17B10TDP1MAPT | |
| SCHEMBL6857480 | 0.73 | CA1 (0.40) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL22276350 | 0.73 | ALDH1A1 (0.43) | CA1CA2CA9ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL9573670 | 0.73 | CA1 (0.40) | CA1CA2CA9ALDH1A1HPGD | |
| SCHEMBL1135140 | 0.73 | CA1 (0.40) | CA1CA2CA9ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0591756-B1 | Polymerization catalysts and process for producing polymers | IDEMITSU KOSAN CO (JP) | 1998-11-25 | — | — | EP | disclosed |
| US-5461127-A | Comprising group 4 metal, cyclic hydrocarbon, ligands, Lewis base; addition polymerization | IDEMITSU KOSAN CO., LTD. (JP) | 1995-10-24 | — | — | US | disclosed |
| EP-0591756-A2 | Polymerization catalysts and process for producing polymers | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1994-04-13 | — | — | EP | disclosed |