Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18359488 | 0.91 | PDE1A (0.45) | KDM4EALDH1A1HPGDRAB9AHTR2A | |
| SCHEMBL18359585 | 0.88 | HTR2A (0.45) | KDM4EALDH1A1RAB9AHTR2AHTR2C | |
| SCHEMBL29732326 | 0.86 | GABRA5 (0.45) | KDM4EALDH1A1RAB9AHTR2AHTR2C | |
| SCHEMBL18326378 | 0.86 | GABRA5 (0.45) | KDM4EALDH1A1RAB9AHTR2AHTR2C | |
| SCHEMBL16896890 | 0.83 | HTR2A (0.43) | KDM4EFEN1ALDH1A1RAB9AHTR2A | |
| SCHEMBL18359490 | 0.83 | ACSS2 (0.41) | KDM4EFEN1ALDH1A1RAB9AHTR2A | |
| SCHEMBL18359548 | 0.82 | BRD4 (0.55) | — | |
| SCHEMBL16896825 | 0.81 | HTR2A (0.44) | KDM4EALDH1A1HTR2AHTR2CPDE1A | |
| SCHEMBL31339944 | 0.81 | KDM4E (0.50) | KDM4EFEN1ALDH1A1GABRA1GABRA5 | |
| SCHEMBL18326380 | 0.79 | PDE4D (0.42) | KDM4EALDH1A1RAB9AHTR2AHTR2C |
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-2017001733-A1 | BICYCLIC HETEROCYCLE DERIVATIVES AS BROMODOMAIN INHIBITORS | ORION CORPORATION (FI) | 2017-01-05 | — | — | WO | disclosed |