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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
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 SCHEMBL6907120 | 0.82 | CYP3A4 (0.37) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL6909984 | 0.79 | PTGS2 (0.35) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL27932999 | 0.76 | CYP3A4 (0.33) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL813276 | 0.76 | CYP3A4 (0.36) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL815618 | 0.76 | BCHE (0.35) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL29213166 | 0.76 | BCHE (0.35) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL27638244 | 0.75 | CYP3A4 (0.33) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL30361351 | 0.75 | CYP3A4 (0.35) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL27501028 | 0.75 | CYP2D6 (0.33) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL2272446 | 0.75 | CYP3A4 (0.35) | CYP3A4CYP2D6CYP2C9TSHRCYP2C19 |
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-6790917-B2 | POLYMERIZING A VINYL COMPOUND IN PRESENCE OF A CATALYST OBTAINED BY COMBINING ORGANOTRANSITION METAL COMPOUND, AN ALUMINUM COMPUND OR ALUMOXANE AND A BORON COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-09-14 | — | — | US | disclosed |
| US-20020198340-A1 | Process for producing vinyl compound polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-12-26 | — | — | US | disclosed |