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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 2/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | CHKA | P35790 | 3/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8381006 | 0.77 | MAOB (0.53) | LTA4HKIF11SMN1; SMN2KCNH2 | |
| SCHEMBL8383387 | 0.77 | LTA4H (0.41) | LTA4HKIF11SMN1; SMN2KCNH2MEN1 | |
| Hydrochloric Acid SCHEMBL8384093 | 0.76 | CA1 (0.40) | CHKALTA4HSMN1; SMN2ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL8381165 | 0.75 | ALDH1A1 (0.49) | CHRNA7LMNAACHELTA4HKIF11 | |
| SCHEMBL8381114 | 0.75 | LTA4H (0.50) | LTA4HKIF11SMN1; SMN2KCNH2 | |
| Hydrochloric Acid SCHEMBL8383473 | 0.74 | KCNH2 (0.50) | CHRNA7LMNAACHELTA4HKIF11 | |
| SCHEMBL8385005 | 0.74 | LTB4R (0.49) | LMNAALDH1A1 | |
| SCHEMBL8381057 | 0.73 | LMNA (0.52) | LMNALTA4HKIF11SMN1; SMN2ALDH1A1 | |
| SCHEMBL8381308 | 0.73 | SMN1; SMN2 (0.42) | LTA4HKIF11SMN1; SMN2ALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL11637202 | 0.72 | ACHE (0.61) | CHKALMNABCHEACHESMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5874436-A | EFFECTIVE IN INHIBITING THE ACTION OF A BACTERIAL HISTIDINE PROTEIN KINASE; USEFUL AGAINST ANTIBIOTIC RESISTANT ORGANISMS | DEMERS JAMES P (US) | 1999-02-23 | — | — | US | disclosed |
| US-5643950-A | INHIBITORS OF A BACTERIAL HISTIDINE PROTEIN KINASE | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |