Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLL | Q9UGP5 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.31 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL136161 | 0.81 | EDNRB (0.34) | ADORA3ARHSD11B1AKR1C3CYP1A2 | |
| (-)-4-Hydroxy-Alpha-Tetralone SCHEMBL19420220 | 0.76 | POLL (0.50) | POLLADORA3ARHSD11B1AKR1C3 | |
| SCHEMBL7535293 | 0.76 | HTR2A (0.46) | NR3C2ANPEPHTR2A | |
| (-)-4-Hydroxy-Alpha-Tetralone SCHEMBL14592023 | 0.76 | POLL (0.50) | POLLADORA3ARHSD11B1AKR1C3 | |
| (-)-4-Hydroxy-Alpha-Tetralone SCHEMBL3694170 | 0.76 | POLL (0.50) | POLLADORA3ARHSD11B1AKR1C3 | |
| SCHEMBL18761553 | 0.76 | ANPEP (0.35) | ANPEPHTR2ASLC6A4SLC6A3 | |
| SCHEMBL7906603 | 0.73 | POLL (0.34) | POLLNR3C2CYP1A2CYP2D6BCHE | |
| SCHEMBL23948898 | 0.71 | S1PR1 (0.42) | POLLNR3C2S1PR1S1PR2S1PR4 | |
| SCHEMBL20540210 | 0.71 | S1PR1 (0.42) | POLLNR3C2S1PR1S1PR2S1PR4 | |
| SCHEMBL5206019 | 0.70 | MEN1 (0.41) | POLLCYP2D6 |
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-2007050795-A2 | TRANSGLUTAMINASE INHIBITORS AND METHODS OF USE THEREOF | ALVINE PHARMACEUTICALS, INC. (US) | 2007-05-03 | — | — | WO | disclosed |