Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9666926 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP2D6CYP2C19MMP9CTNNB1 | |
| SCHEMBL8484930 | 0.81 | CTNNB1 (0.51) | CYP1A2CYP2D6CYP2C19CTNNB1ALDH1A1 | |
| SCHEMBL7299907 | 0.80 | ALOX15 (0.46) | CYP2C19MMP9 | |
| SCHEMBL7330802 | 0.79 | HTR1B (0.47) | HTR1BCYP1A2CYP2D6CYP2C19MMP9 | |
| SCHEMBL6445467 | 0.79 | HTR1B (0.47) | HTR1BCYP1A2CYP2D6CYP2C19MMP9 | |
| SCHEMBL6448451 | 0.78 | HTR1B (0.43) | HTR1BCYP1A2CYP2D6CYP2C19MMP9 | |
| SCHEMBL7271887 | 0.77 | KMT2A (0.54) | CYP1A2CYP2D6CYP2C19CTNNB1ALDH1A1 | |
| SCHEMBL7294849 | 0.76 | CTNNB1 (0.44) | CYP1A2CYP2D6CYP2C19MMP9CTNNB1 | |
| SCHEMBL6709447 | 0.75 | CTNNB1 (0.43) | CYP1A2CYP2D6CYP2C19MMP9CTNNB1 | |
| SCHEMBL7296607 | 0.75 | CTNNB1 (0.41) | CYP1A2CYP2D6CYP2C19CTNNB1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0521827-A1 | Pharmacological active hydrazin derivatives and process for their preparation | CIBA-GEIGY AG (CH) | 1993-01-07 | — | — | EP | disclosed |