Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11741921 | 0.70 | CYP1A2 (0.44) | CYP1A2GRM5FFAR1NPC1RAB9A | |
| SCHEMBL11746901 | 0.70 | CYP1A2 (0.44) | CYP1A2GRM5FFAR1NPC1RAB9A | |
| SCHEMBL11746719 | 0.67 | — | — | |
| SCHEMBL4854449 | 0.67 | — | — | |
| SCHEMBL11744141 | 0.67 | — | — | |
| SCHEMBL4222484 | 0.67 | — | — | |
| SCHEMBL5774580 | 0.67 | — | — | |
| SCHEMBL4098240 | 0.67 | CYP1A2 (0.42) | CYP1A2GRM5FFAR1NPC1RAB9A | |
| SCHEMBL4892059 | 0.65 | GRM5 (0.48) | CYP1A2GRM5FFAR1NPC1RAB9A | |
| SCHEMBL150206 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020111140-A1 | FUSED RING COMPOUND, PRODUCTION METHOD THEREFOR, AND ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL | 東ソー株式会社 | 2020-06-04 | — | — | WO | disclosed |