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 | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 6/20 | 0.44 |
| ▸ | CHRM3 known ✓ | P20309 | 6/20 | 0.44 |
| ▸ | CHRM2 known ✓ | P08172 | 5/20 | 0.42 |
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.40 |
| ▸ | APEX1 | P27695 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL692516 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL6236672 | 0.97 | CHRM5 (0.42) | CHRM5CHRM1CHRM3MAPTBLM | |
| SCHEMBL22645 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL515868 | 0.94 | CHRM5 (0.41) | CHRM5CHRM1CHRM3MAPTBLM | |
| Bromide SCHEMBL3918164 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL28075634 | 0.94 | CHRM5 (0.40) | CHRM5CHRM1CHRM3MAPTBLM | |
| Hydrochloric Acid SCHEMBL8996405 | 0.94 | — | — | |
| SCHEMBL28191171 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL8470519 | 0.89 | CHRM5 (0.38) | CHRM5CHRM1CHRM3MAPTBLM | |
| Urea SCHEMBL28732112 | 0.85 | CHRM5 (0.59) | CHRM5CHRM1CHRM3MAPTBLM |
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 |
|---|---|---|---|---|---|---|---|
| CN-103826452-B | Pesticidal compositions and processes related thereto | 陶氏益农公司 | 2017-02-01 | — | — | CN | disclosed |
| CN-106165684-A | Pesticidal compositions and methods relating thereto | 陶氏益农公司 | 2016-11-30 | — | — | CN | disclosed |
| CN-103748089-B | Pesticidal compositions and methods relating thereto | 陶氏益农公司 | 2016-08-17 | — | — | CN | disclosed |