Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 11/20 | 0.63 |
| ▸ | USP2 | O75604 | 9/20 | 0.63 |
| ▸ | TSHR | P16473 | 4/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.58 |
| ▸ | CNR1 | P21554 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 1/20 | 0.54 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.54 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.54 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.54 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.54 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.54 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.54 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL14934443 | 0.83 | EPHX2 (0.64) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934572 | 0.83 | EPHX2 (0.64) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934433 | 0.82 | EPHX2 (0.65) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934418 | 0.82 | EPHX2 (0.59) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934363 | 0.81 | EPHX2 (0.66) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934518 | 0.80 | EPHX2 (0.80) | CYP3A4USP2CYP2C9ALDH1A1EPHX2 | |
| SCHEMBL14934414 | 0.80 | CYP3A4 (0.70) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934360 | 0.80 | EPHX2 (0.67) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934394 | 0.79 | CYP3A4 (0.65) | CYP3A4USP2TSHRCYP2C9ALDH1A1 | |
| SCHEMBL14934392 | 0.79 | USP2 (0.68) | CYP3A4USP2TSHRCYP2C9ALDH1A1 |
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 |