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 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.30 |
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 SCHEMBL4462291 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL4479648 | 0.90 | CNR1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4460785 | 0.89 | CNR1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL4473009 | 0.86 | AKR1C3 (0.32) | AKR1C3AKR1C2 | |
| Hydrochloric Acid SCHEMBL5691375 | 0.85 | SLC6A4 (0.32) | — | |
| Hydrochloric Acid SCHEMBL4473062 | 0.84 | AKR1C3 (0.31) | AKR1C3AKR1C2 | |
| Hydrochloric Acid SCHEMBL4469402 | 0.84 | METAP2 (0.35) | — | |
| SCHEMBL28742530 | 0.78 | AKR1C3 (0.32) | AKR1C3AKR1C2CRHR1 | |
| Hydrochloric Acid SCHEMBL5691720 | 0.78 | NPC1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4474485 | 0.78 | ALDH1A1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7569651-B2 | Transition metal compound, ligand system, catalyst system and its use for the polymerization and copolymerization of olefins | BASELL POLYPROPYLEN GMBH (DE) | 2009-08-04 | — | — | US | disclosed |
| US-7342078-B2 | Transition metal compound, ligand system, catalyst system and the use of the latter for polymerisation and copolymerisation of olefins | BASELL POLYOLEFINE GMBH (DE) | 2008-03-11 | — | — | US | disclosed |
| US-20060020096-A1 | Transition metal compound, ligand system, catalyst system and its use for the polymerization and copolymerization of olefins | SCHOTTEK JORG | 2006-01-26 | — | — | US | disclosed |