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 | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 SCHEMBL5608731 | 0.72 | CALM1 (0.37) | CALM1TAAR1CYP1A2LMNAADRA2A | |
| Hydrochloric Acid SCHEMBL18585839 | 0.69 | CALM1 (0.37) | CALM1TAAR1CYP1A2LMNAADRA2A | |
| SCHEMBL2352229 | 0.66 | CALM1 (0.52) | CALM1TAAR1LMNATSHRLTA4H | |
| Hydrochloric Acid SCHEMBL4465529 | 0.66 | BCHE (0.30) | — | |
| Hydrochloric Acid SCHEMBL618163 | 0.63 | — | — | |
| SCHEMBL2031509 | 0.62 | CALM1 (0.52) | CALM1TAAR1CYP1A2LMNAADRA2A | |
| SCHEMBL8198124 | 0.62 | CALM1 (0.52) | CALM1TAAR1CYP1A2LMNAADRA2A | |
| SCHEMBL9861098 | 0.62 | MAPK1 (0.42) | CALM1TAAR1CYP1A2LMNAIDH1 | |
| Hydrochloric Acid SCHEMBL2233373 | 0.61 | CALM1 (0.39) | CALM1TAAR1CYP1A2LMNAADRA2A | |
| SCHEMBL3040732 | 0.61 | TBXAS1 (0.50) | CALM1TBXAS1CYP1A2LMNALTA4H |
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-6329312-B1 | POLYMERIZATION CATALYSTS FOR OLEFINS USING METALLOCENES AND ORGANOMETALLIC COCATALYSTS | PHILLIPS PETROLEUM COMPANY | 2001-12-11 | — | — | US | claimed |