Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL134606 | 0.97 | CYP3A4 (0.35) | CYP3A4MAPK1MAPTGABRA2GABRB2 | |
| SCHEMBL217662 | 0.93 | CYP3A4 (0.34) | CYP3A4MAPK1MAPTGABRA2GABRB2 | |
| SCHEMBL1481145 | 0.83 | GPBAR1 (0.33) | — | |
| SCHEMBL6053995 | 0.83 | GABRA2 (0.33) | GABRA2GABRB2RIPK1 | |
| SCHEMBL6054044 | 0.82 | GABRA2 (0.32) | GABRA2GABRB2 | |
| SCHEMBL6054015 | 0.82 | GABRA2 (0.32) | GABRA2GABRB2 | |
| SCHEMBL6053928 | 0.82 | GABRA2 (0.32) | GABRA2GABRB2 | |
| SCHEMBL6054088 | 0.82 | GABRA2 (0.32) | GABRA2GABRB2 | |
| SCHEMBL140047 | 0.80 | LMNA (0.38) | CYP3A4MAPK1TSHRPDE2A | |
| SCHEMBL628169 | 0.79 | GABRA2 (0.36) | CYP3A4MAPK1MAPTGABRA2GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1603956-A2 | CATALYST COMPOSITION | ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) | 2005-12-14 | — | — | EP | disclosed |
| WO-2004085497-A2 | CATALYST COMPOSITION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2004-10-07 | — | — | WO | disclosed |