Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL15702586 | 0.88 | PYCR1 (0.49) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL24345065 | 0.86 | PYCR1 (0.53) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL26656360 | 0.85 | KDM4E (0.43) | CYP3A4CYP1A2CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL11461540 | 0.80 | BCHE (0.53) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL2657018 | 0.77 | SLC6A2 (0.52) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL11453476 | 0.76 | HRH3 (0.48) | — | |
| SCHEMBL11466186 | 0.74 | TSHR (0.53) | PYCR1IDO1CYP3A4 | |
| SCHEMBL31500392 | 0.74 | TSHR (0.53) | PYCR1IDO1CYP3A4 | |
| SCHEMBL26677103 | 0.74 | PYCR1 (0.65) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL12448907 | 0.74 | IDO1 (0.45) | PYCR1IDO1CYP3A4CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4197243-A | ANTIPSYCHOTICS, STRONG CNS DEPRESSANTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1980-04-08 | — | — | US | disclosed |
| US-4097487-A | CNS DEPRESSANTS, ANTIPSYCHOTICS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) | 1978-06-27 | — | — | US | disclosed |