Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GMNN | O75496 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16878592 | 1.00 | CYP1A2 (0.42) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL13587677 | 0.82 | SPHK2 (0.45) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL16705753 | 0.81 | SOAT2 (0.38) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL10081526 | 0.81 | SOAT2 (0.38) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL10081520 | 0.81 | SOAT2 (0.38) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL30132385 | 0.81 | SOAT2 (0.38) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR | |
| SCHEMBL23387066 | 0.80 | ALDH1A1 (0.41) | ALDH1A1SOAT2SOAT1FAAHPPARG | |
| SCHEMBL5276231 | 0.79 | S1PR1 (0.49) | CYP1A2CYP2C9CYP2C19CYP2D6MEN1 | |
| SCHEMBL5276226 | 0.79 | S1PR1 (0.49) | CYP1A2CYP2C9CYP2C19CYP2D6MEN1 | |
| SCHEMBL17976784 | 0.79 | CYP1A2 (0.36) | CYP1A2CYP2C9CYP2C19CYP3A4TSHR |
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-2015103505-A2 | DIRECT STEREOSPECIFIC SYNTHESIS OF UNPROTECTED AZIRIDINES FROM OLEFINS | ESS DANIEL HALSELL (US) | 2015-07-09 | — | — | WO | disclosed |