Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 7/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5053642 | 0.96 | CYP19A1 (0.50) | CYP19A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL18925015 | 0.84 | MEN1 (0.64) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL16263167 | 0.84 | CYP2D6 (0.47) | CYP19A1CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL28525427 | 0.81 | CYP19A1 (0.60) | CYP19A1NPC1RAB9AATMMEN1 | |
| SCHEMBL5049564 | 0.80 | MEN1 (0.49) | CYP1A2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL29966023 | 0.80 | MEN1 (0.49) | CYP19A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL16264735 | 0.79 | MEN1 (0.50) | CYP19A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL5051923 | 0.78 | HDAC3 (0.64) | NPC1RAB9AMEN1KMT2AL3MBTL1 | |
| SCHEMBL28561223 | 0.77 | MEN1 (0.44) | CYP19A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL9137418 | 0.77 | SRC (0.60) | CYP19A1NPC1RAB9AATMMEN1 |
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-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | claimed |
| EP-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | disclosed |