Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | APAF1 | O14727 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29349567 | 0.85 | NPC1 (0.41) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| SCHEMBL29241 | 0.85 | NPC1 (0.41) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| SCHEMBL11668139 | 0.83 | NPC1 (0.43) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| Toluene SCHEMBL29114789 | 0.82 | NPC1 (0.46) | NPC1RAB9ACYP1A2CYP3A4CYP2C9 | |
| Bumetrizole SCHEMBL8250511 | 0.81 | NPC1 (0.54) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| SCHEMBL6325507 | 0.81 | NPC1 (0.35) | NPC1RAB9AHSP90AA1TSHRLMNA | |
| SCHEMBL6325514 | 0.81 | MAPT (0.41) | NPC1RAB9AHSP90AA1POLBKDM4E | |
| Pyrrole SCHEMBL28116614 | 0.81 | NPC1 (0.39) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| SCHEMBL23908723 | 0.81 | NPC1 (0.38) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 | |
| SCHEMBL22372500 | 0.81 | NPC1 (0.44) | NPC1RAB9AHSP90AA1CYP1A2CYP3A4 |
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-20050191476-A1 | Epoxy resin composition excellent in weather resistance and fiber-reinforced composite materials | TORAY INDUSTRIES, INC. A CORPORATION OF JAPAN (JP) | 2005-09-01 | — | — | US | disclosed |
| EP-1454956-A1 | EPOXY RESIN COMPOSITION EXCELLENT IN WEATHER RESISTANCE AND FIBER-REINFORCED COMPOSITE MATERIALS | TORAY INDUSTRIES, INC. (JP) | 2004-09-08 | — | — | EP | disclosed |