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 | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.57 |
| ▸ | CCR1 | P32246 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | CCR5 | P51681 | 3/20 | 0.50 |
| ▸ | CCR8 | P51685 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9528545 | 0.98 | PDE10A (0.58) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL27915486 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL27971229 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL28813000 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL10480813 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL31026567 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL31026595 | 0.97 | PDE10A (0.57) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL31026587 | 0.94 | PDE10A (0.60) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL4584933 | 0.94 | PDE10A (0.60) | PDE10ACCR1LMNATDP1CCR5 | |
| SCHEMBL29035539 | 0.86 | LMNA (0.51) | PDE10ACCR1LMNATDP1CCR5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109701645-B | Catalyst composition and application thereof | 中国石油化工股份有限公司 | 2021-12-21 | — | — | CN | disclosed |