Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.36 |
| ▸ | GABRE | P78334 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4174001 | 0.84 | GRM5 (0.49) | GRM5FFAR1LMNA | |
| SCHEMBL10145007 | 0.84 | HDAC4 (0.41) | HDAC4HDAC2HDAC8ACHECYP2D6 | |
| SCHEMBL10145006 | 0.81 | SLC1A5 (0.36) | HDAC4HDAC2HDAC8ACHEKIF11 | |
| SCHEMBL12203266 | 0.77 | NPC1 (0.36) | HDAC4HDAC2HDAC8ACHEKIF11 | |
| SCHEMBL28676056 | 0.77 | HDAC8 (0.40) | HDAC4HDAC2HDAC8ACHEKIF11 | |
| SCHEMBL8960112 | 0.76 | RARB (0.48) | ACHENPSR1KIF11GABRPGABRD | |
| SCHEMBL8993127 | 0.75 | GRM5 (0.52) | ACHECYP2D6NPSR1HAO1GRM5 | |
| SCHEMBL4513477 | 0.74 | KIF11 (0.41) | HDAC4HDAC2HDAC8ACHEKIF11 | |
| SCHEMBL34460063 | 0.74 | KIF11 (0.41) | HDAC4HDAC2HDAC8ACHEKIF11 | |
| SCHEMBL8960313 | 0.74 | HDAC8 (0.44) | HDAC4HDAC2HDAC8ACHEKIF11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0436398-B1 | Acetylenes disubstituted with a heteroaromatic group and a substituted phenyl group having retinoid like activity | ALLERGAN INC (US) | 1996-01-31 | — | — | EP | disclosed |