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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.36 |
| ▸ | CHRNA10 | Q9GZZ6 | 2/20 | 0.36 |
| ▸ | CHRNA9 | Q9UGM1 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5297631 | 0.98 | SIGMAR1 (0.39) | SIGMAR1MAOAACHECHRNA7CHRNA10 | |
| Hydrochloric Acid SCHEMBL21051230 | 0.93 | CHRNA7 (0.44) | SIGMAR1MAOACHRNA7CHRNA10CHRNA9 | |
| Hydrochloric Acid SCHEMBL21082787 | 0.89 | CYP2D6 (0.39) | MAOAMAOBHTR2A | |
| SCHEMBL28185788 | 0.89 | SIGMAR1 (0.38) | SIGMAR1 | |
| SCHEMBL8369382 | 0.87 | CYP2D6 (0.40) | MAOAMAOBHTR2A | |
| Benzylimidazole SCHEMBL1123480 | 0.82 | ALDH1A1 (0.49) | ACHE | |
| Bromide SCHEMBL1887326 | 0.80 | CHRNA7 (0.40) | MAOACHRNA7CHRNA10CHRNA9MAOB | |
| Bromide SCHEMBL1885288 | 0.80 | CHRNA7 (0.40) | SIGMAR1CHRNA7CHRNA10CHRNA9MAOB | |
| Bromide SCHEMBL1889476 | 0.80 | CHRNA7 (0.40) | CHRNA7CHRNA10CHRNA9HTR2A | |
| Bromide SCHEMBL1883010 | 0.80 | CHRNA7 (0.46) | CHRNA7CHRNA10CHRNA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019078514-A1 | METHOD FOR PRODUCING GRAFT COPOLYMER COMPOSITE, GRAFT COPOLYMER COMPOSITE, AND THERMOPLASTIC RESIN COMPOSITION INCLUDING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |