Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 15/20 | 0.66 |
| ▸ | CHRNE | Q04844 | 2/20 | 0.61 |
| ▸ | BCHE | P06276 | 10/20 | 0.58 |
| ▸ | GRIN1 | Q05586 | 9/20 | 0.54 |
| ▸ | GRIN2A | Q12879 | 9/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.54 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.54 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.54 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.54 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.54 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.54 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.54 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.54 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL12043412 | 0.97 | ACHE (0.70) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL8018144 | 0.83 | ACHE (0.68) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL8015786 | 0.83 | ACHE (0.94) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL3458913 | 0.81 | ACHE (0.74) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL10655775 | 0.80 | ACHE (0.46) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL12043414 | 0.79 | ACHE (1.00) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL12043411 | 0.79 | ACHE (0.72) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL30411626 | 0.78 | ACHE (0.70) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL10651152 | 0.78 | ACHE (0.43) | ACHECHRNEBCHEGRIN1GRIN2A | |
| SCHEMBL8019759 | 0.75 | ACHE (0.94) | ACHECHRNEBCHEGRIN1GRIN2A |
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-6130228-A | Polycyclic compounds | UNIVERSITY OF STRATHCLYDE (GB) | 2000-10-10 | — | — | US | disclosed |