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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.32 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6251442 | 0.90 | CHRM1 (0.37) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL31039630 | 0.90 | CHRM1 (0.37) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL31039631 | 0.89 | CHRM1 (0.35) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL6250497 | 0.89 | CHRM1 (0.35) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL30150710 | 0.86 | CHRM1 (0.36) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL7764738 | 0.80 | CHRM2 (0.33) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL8959950 | 0.79 | CHRM2 (0.32) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL28430120 | 0.77 | CHRM2 (0.34) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Benzoic Acid SCHEMBL7764284 | 0.74 | CA2 (0.39) | — | |
| SCHEMBL6932058 | 0.72 | CHRM1 (0.39) | CHRM2HTR1AADRA2ACHRM1DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5596054-A | COORDINATION CATALYSTS FOR ADDITION POLYMERIZATION | IDEMITSU KOSAN CO., LTD. (JP) | 1997-01-21 | — | — | US | disclosed |