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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 4/20 | 0.36 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4842961 | 0.82 | ESR1 (0.38) | ESR1ESR2ALDH1A1CYP3A4CNR1 | |
| Hydrochloric Acid SCHEMBL29556759 | 0.81 | ALDH1A1 (0.34) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL540223 | 0.81 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL4833326 | 0.78 | CNR1 (0.37) | ESR1ESR2ALDH1A1CYP3A4CNR1 | |
| Bromide SCHEMBL27651355 | 0.78 | ALDH1A1 (0.34) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30925343 | 0.77 | NPC1 (0.37) | ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL30739105 | 0.72 | CNR1 (0.49) | ESR1ESR2ALDH1A1CYP3A4CNR1 | |
| SCHEMBL26981212 | 0.72 | CNR1 (0.49) | ESR1ESR2ALDH1A1CYP3A4CNR1 | |
| Hydrochloric Acid SCHEMBL5077743 | 0.71 | CNR1 (0.31) | CNR1CNR2 | |
| Hydrochloric Acid SCHEMBL5077683 | 0.71 | CNR1 (0.30) | CNR1CNR2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1632505-B1 | ETHYLENE POLYMER | MITSUI CHEMICALS INC (JP) | 2016-09-07 | — | — | EP | disclosed |
| EP-2465879-A1 | Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same | Mitsui Chemicals, Inc. (JP) | 2012-06-20 | — | — | EP | disclosed |
| US-7452946-B2 | copolymer with C3 to C10 alpha -olefin; provides a blow-molded product and an extrusion-molded product excellent in moldability, mechanical strength and outward appearance; produced in the presence of a solid catalyst | MITSUI CHEMICALS, INC. (JP) | 2008-11-18 | — | — | US | disclosed |
| US-20060199925-A1 | Ethylene polymer | MITSUI CHEMICALS, INC. (JP) | 2006-09-07 | — | — | US | disclosed |
| EP-1632505-A1 | ETHYLENE POLYMER | Mitsui Chemicals, Inc. (JP) | 2006-03-08 | — | — | EP | disclosed |