Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 4/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1154616 | 0.77 | L3MBTL1 (0.44) | ARPGRKDM4EALDH1A1HPGD | |
| SCHEMBL9082431 | 0.76 | MEN1 (0.36) | ALDH1A1MEN1KMT2ANPSR1GRM5 | |
| SCHEMBL9015004 | 0.74 | AR (0.42) | ARPGRKDM4EALDH1A1HPGD | |
| SCHEMBL8410613 | 0.74 | DHFR (0.44) | ARPGRKDM4EALDH1A1HPGD | |
| SCHEMBL8410372 | 0.73 | AR (0.40) | ARPGRKDM4EALDH1A1HPGD | |
| SCHEMBL2075358 | 0.71 | L3MBTL1 (0.42) | ARPGRKDM4EALDH1A1HPGD | |
| SCHEMBL9014961 | 0.71 | GRM5 (0.39) | GRM5 | |
| SCHEMBL2768310 | 0.70 | GRM5 (0.36) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL853825 | 0.70 | GRM5 (0.49) | GRM5 | |
| SCHEMBL19781320 | 0.68 | TRPV4 (0.45) | GRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0746542-A1 | THERAPEUTIC BENZONITRILES | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-12-11 | — | — | EP | disclosed |
| WO-1995023134-A1 | THERAPEUTIC BENZONITRILES | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-08-31 | — | — | WO | disclosed |