Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 7/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13140894 | 0.87 | CNR2 (0.46) | CNR2MAOBMMP8PPARGPPARA | |
| SCHEMBL12585628 | 0.86 | PPARA (0.50) | CNR2MAOBMMP8PPARGPPARA | |
| SCHEMBL13141048 | 0.86 | IDO1 (0.51) | CNR2MAOBMMP8PPARGPPARA | |
| SCHEMBL2060663 | 0.85 | CNR2 (0.45) | CNR2MAOBMMP8PPARGPPARA | |
| SCHEMBL14232380 | 0.85 | LOXL2 (0.54) | CNR2LOXL2MAOBCYP1A2CYP2C19 | |
| SCHEMBL15630699 | 0.84 | RORC (0.51) | CNR2LOXL2MAOBMMP8PPARA | |
| Hydrochloric Acid SCHEMBL15609606 | 0.83 | RORC (0.50) | CNR2LOXL2MAOBMMP8PPARA | |
| SCHEMBL6580520 | 0.83 | PPARA (0.46) | CNR2MAOBMMP8PPARGPPARA | |
| SCHEMBL6161136 | 0.82 | CNR2 (0.50) | CNR2MAOBMMP8KDM4ECYP1A2 | |
| SCHEMBL2060134 | 0.81 | CNR2 (0.52) | CNR2MAOBMMP8PPARGPPARA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103003266-A | Hydroxyalkylbenzylpyrazoles and their use for the treatment of hyperproliferative and angiogenic diseases | BAYER IP GMBH | 2013-03-27 | — | — | CN | disclosed |
| CN-101668747-B | Tetrahydroisoquinolin-1-one derivatives or salts thereof | ASTELLAS PHARMA INC. (JP) | 2012-02-01 | — | — | CN | disclosed |
| CN-101668747-A | Tetrahydroisoquinolin-1-one derivatives or salts thereof | ASTELLAS PHARMA INC | 2010-03-10 | — | — | CN | disclosed |