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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | STAT1 | P42224 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 5/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 4/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 1/20 | 0.31 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5015310 | 0.97 | STAT3 (0.38) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL31040338 | 0.96 | STAT3 (0.37) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL27999723 | 0.96 | STAT3 (0.37) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL28367025 | 0.96 | STAT3 (0.37) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL27859875 | 0.96 | STAT3 (0.37) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL28562984 | 0.94 | STAT3 (0.42) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL28999747 | 0.85 | STAT3 (0.38) | STAT3STAT1 | |
| SCHEMBL5470465 | 0.84 | STAT3 (0.38) | STAT3STAT1MAPK14MAPK13MAPK12 | |
| Hydrochloric Acid SCHEMBL29209979 | 0.83 | STAT3 (0.36) | STAT3STAT1GCGRMAPK14MAPK13 | |
| SCHEMBL11569705 | 0.82 | STAT3 (0.38) | STAT3STAT1MAPK14MAPK13MAPK12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104327036-B | A kind of preparation method of cyclic carbonate | 中国科学院长春应用化学研究所 | 2017-03-29 | — | — | CN | disclosed |
| CN-104448283-B | A kind of preparation method of Merlon | 中国科学院长春应用化学研究所 | 2016-09-28 | — | — | CN | disclosed |
| CN-104448283-A | Preparation method of polycarbonate | CHANGCHUN APPLIED CHEMISTRY | 2015-03-25 | — | — | CN | disclosed |
| CN-104327036-A | Preparation method of cyclic carbonate | CHANGCHUN APPLIED CHEMISTRY | 2015-02-04 | — | — | CN | disclosed |