Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11067122 | 1.00 | CYP1A2 (0.35) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL11067119 | 1.00 | CYP1A2 (0.35) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL11073517 | 0.95 | CYP1A2 (0.31) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL11073506 | 0.95 | CYP1A2 (0.31) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL11073511 | 0.95 | CYP1A2 (0.31) | CYP1A2LMNAMAPK1HTT | |
| SCHEMBL11074070 | 0.94 | EPHX1 (0.31) | CYP1A2HTT | |
| SCHEMBL11074147 | 0.94 | EPHX1 (0.31) | CYP1A2HTT | |
| SCHEMBL11074072 | 0.94 | EPHX1 (0.31) | CYP1A2HTT | |
| SCHEMBL11073621 | 0.94 | EPHX1 (0.31) | CYP1A2HTT | |
| SCHEMBL11068127 | 0.94 | EPHX1 (0.31) | CYP1A2HTT |
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-4434073-A | Perhydrophenanthrene derivatives, their preparation, and their use in liquid-crystalline dielectrics and electro-optical display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-02-28 | — | — | US | disclosed |