Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 14/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | STS | P08842 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4063735 | 0.87 | CYP19A1 (0.41) | MAPTGSK3AGSK3BCYP19A1LMNA | |
| SCHEMBL13848418 | 0.84 | CYP19A1 (0.42) | CYP19A1KDM4ELMNAKMT2A | |
| SCHEMBL13848385 | 0.83 | TSHR (0.44) | MEN1KMT2A | |
| SCHEMBL13848084 | 0.82 | TSHR (0.46) | MEN1KMT2A | |
| SCHEMBL13848454 | 0.82 | NPC1 (0.44) | KDM4EMEN1KMT2A | |
| SCHEMBL13848378 | 0.82 | RAB9A (0.47) | MEN1KMT2A | |
| SCHEMBL4065758 | 0.81 | CYP19A1 (0.41) | CYP19A1 | |
| SCHEMBL13848091 | 0.80 | IDO1 (0.39) | GSK3BCYP19A1MEN1KMT2ACYP1A2 | |
| SCHEMBL13848452 | 0.80 | MAPK14 (0.37) | CYP19A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4068393 | 0.80 | CYP19A1 (0.49) | MAPTCYP19A1LMNASTS |
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-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |