Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 3/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6456548 | 1.00 | PAX8 (0.37) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6455918 | 0.97 | PAX8 (0.36) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6455922 | 0.97 | PAX8 (0.36) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6457033 | 0.96 | MGLL (0.38) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6464502 | 0.96 | MGLL (0.38) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6464505 | 0.96 | MGLL (0.38) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6457028 | 0.96 | MGLL (0.38) | PAX8TAAR1MGLLKDM1AMAOA | |
| SCHEMBL6452617 | 0.93 | PAX8 (0.38) | PAX8TAAR1KDM1AMAOAMAOB | |
| SCHEMBL6452615 | 0.93 | PAX8 (0.38) | PAX8TAAR1KDM1AMAOAMAOB | |
| SCHEMBL6454569 | 0.90 | RAB9A (0.34) | CNR2ESR2MEN1GAAMAPK1 |
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-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |