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 | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.37 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 SCHEMBL2036881 | 0.88 | HPGD (0.44) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL2036089 | 0.85 | HPGD (0.43) | CYP2C19HPGDALDH1A1SMN1; SMN2HDAC1 | |
| Hydrochloric Acid SCHEMBL2033382 | 0.81 | CYP2C19 (0.44) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL2035441 | 0.80 | CYP2C19 (0.46) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL5853691 | 0.80 | CYP2C19 (0.43) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL5856427 | 0.80 | CYP2C19 (0.43) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL5852878 | 0.78 | CYP2C19 (0.41) | CYP2C19HPGDALDH1A1KDM4EP2RX7 | |
| Hydrochloric Acid SCHEMBL2046037 | 0.77 | KMT2A (0.42) | HPGDALDH1A1KDM4ESMN1; SMN2HDAC1 | |
| Hydrochloric Acid SCHEMBL2039364 | 0.76 | KCNK3 (0.44) | CYP2C19HPGDALDH1A1SMN1; SMN2KCNK3 | |
| Hydrochloric Acid SCHEMBL5855920 | 0.75 | HPGD (0.43) | CYP2C19HPGDALDH1A1SMN1; SMN2HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011075596-A1 | CRYSTALLINE FORMS OF CERTAIN 3-PHENYL-PYRAZOLE DERIVATIVES AS MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-06-23 | — | — | WO | disclosed |