Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 16/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.65 |
| ▸ | TSHR | P16473 | 4/20 | 0.64 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 7/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.56 |
| ▸ | CNR2 | P34972 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL14934392 | 0.91 | USP2 (0.68) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934402 | 0.90 | TRPV1 (0.60) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934433 | 0.83 | EPHX2 (0.65) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934412 | 0.82 | EPHX2 (0.62) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934443 | 0.82 | EPHX2 (0.64) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934572 | 0.82 | EPHX2 (0.64) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934481 | 0.81 | EPHX2 (0.69) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934447 | 0.81 | EPHX2 (0.66) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934475 | 0.81 | EPHX2 (0.72) | CYP3A4CYP1A2TSHREPHX2USP2 | |
| SCHEMBL14934432 | 0.81 | EPHX2 (0.63) | CYP3A4CYP1A2TSHREPHX2USP2 |
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-2013065712-A1 | DIAZASPIROUREA DERIVATIVE AND PHARMACEUTICAL USE THEREOF | 東レ株式会社 (JP) | 2013-05-10 | — | — | WO | disclosed |