Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 4/20 | 0.57 |
| ▸ | BCL2 | P10415 | 4/20 | 0.51 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3988740 | 0.87 | HTR7 (0.58) | HTR7BCL2BAK1HRH3BCL2L1 | |
| Hydrochloric Acid SCHEMBL9182345 | 0.86 | HTR7 (0.57) | HTR7BCL2BAK1HRH3BCL2L1 | |
| Hydrochloric Acid SCHEMBL5113101 | 0.86 | HTR7 (0.57) | HTR7BCL2BAK1HRH3BCL2L1 | |
| SCHEMBL2194377 | 0.85 | HTR7 (0.63) | HTR7BCL2BAK1HRH3KDM4E | |
| Hydrochloric Acid SCHEMBL9859525 | 0.84 | HTR7 (0.62) | HTR7BCL2BAK1HRH3BCL2L1 | |
| SCHEMBL2116073 | 0.84 | HTR7 (0.53) | HTR7BCL2BAK1BCL2L1KDM4E | |
| SCHEMBL588394 | 0.84 | SIGMAR1 (0.67) | HTR7BCL2BAK1KDM4EALDH1A1 | |
| SCHEMBL7594371 | 0.83 | SIGMAR1 (0.52) | HTR7KDM4EALDH1A1MAPTDRD2 | |
| SCHEMBL1138135 | 0.82 | HTR7 (0.60) | HTR7BCL2BAK1HRH3BCL2L1 | |
| Hydrochloric Acid SCHEMBL587708 | 0.82 | SIGMAR1 (0.65) | HTR7BCL2BAK1KDM4EALDH1A1 |
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-2003104212-A1 | A NOVEL AMORPHOUS FORM OF [2-[4-[(4-CHLOROPHENYL)-PHENYL METHYL]-1- PIPERAZINYL] ETHOXY] ACETIC ACID DIHYDROCHLORIDE (CETIRIZINE DIHYDROCHLORIDE) | DR.REDDY'S LABORATORIES LTD. (IN) | 2003-12-18 | — | — | WO | disclosed |