Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | KDM4A | O75164 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6950305 | 0.85 | GRIN2B (0.40) | TDP1AKR1C3 | |
| SCHEMBL6959676 | 0.85 | AKR1C3 (0.40) | TDP1AKR1C3AKR1C2NPC1ALDH1A1 | |
| SCHEMBL6959185 | 0.85 | HTR2B (0.39) | TDP1HTR2CHTR2BHDAC8DRD2 | |
| SCHEMBL6952411 | 0.85 | TDP1 (0.39) | TDP1AKR1C3AKR1C2 | |
| SCHEMBL6953224 | 0.85 | TDP1 (0.39) | TDP1AKR1C3AKR1C2 | |
| SCHEMBL6952484 | 0.79 | HTR2C (0.37) | HTR2CHTR2BDRD2HTR2A | |
| SCHEMBL8807404 | 0.79 | HTR2B (0.34) | HTR2CHTR2BDRD2HTR2A | |
| SCHEMBL8807409 | 0.79 | HTR2B (0.34) | HTR2CHTR2BDRD2HTR2A | |
| SCHEMBL6952490 | 0.79 | HTR2C (0.37) | HTR2CHTR2BDRD2HTR2A | |
| SCHEMBL8612852 | 0.79 | TDP1 (0.41) | TDP1 |
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-0757677-B1 | BENZOCYCLOHEXYLIMIDAZOLETHIONE DERIVATIVES | SYNTEX LLC (US) | 2003-06-18 | — | — | EP | disclosed |