Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8976855 | 0.88 | ALDH1A1 (0.35) | CYP1A2CYP2C19CYP3A4TSHRTNFRSF1A | |
| SCHEMBL8976801 | 0.82 | APEX1 (0.37) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL8976796 | 0.75 | GABRA1 (0.30) | — | |
| SCHEMBL8977041 | 0.75 | GAA (0.40) | TSHRALDH1A1LMNA | |
| SCHEMBL17796041 | 0.69 | CYP1A2 (0.33) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL10789196 | 0.67 | GABRA1 (0.32) | POLB | |
| SCHEMBL10906973 | 0.67 | GABRA1 (0.32) | POLB | |
| SCHEMBL3417517 | 0.67 | CYP2C19 (0.42) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL17807568 | 0.65 | CYP3A4 (0.37) | CYP1A2CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL9659513 | 0.64 | LMNA (0.30) | LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5534646-A | OXIDATION RESISTANCE FOR POLYMERS | CIBA-GEIGY CORPORATION (US) | 1996-07-09 | — | — | US | disclosed |