Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 5/20 | 0.78 |
| ▸ | CCKBR | P32239 | 2/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | HTT | P42858 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 4/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17760585 | 0.89 | CCKBR (0.74) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL17760612 | 0.89 | CCKBR (0.74) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL1922309 | 0.88 | PDE5A (0.81) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL14121801 | 0.88 | PDE5A (1.00) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL8320305 | 0.88 | PDE5A (1.00) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL14121773 | 0.88 | PDE5A (1.00) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL14121637 | 0.88 | PDE5A (1.00) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL8320595 | 0.88 | PDE5A (0.77) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL17760644 | 0.88 | PDE5A (0.81) | PDE5ACCKBRKDM4EHSD17B10TSHR | |
| SCHEMBL17760544 | 0.88 | PDE5A (0.81) | PDE5ACCKBRKDM4EHSD17B10TSHR |
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-2004113336-A1 | CARBOLINE AND BETACARBOLINE DERIVATIVES FOR USE AS HDAC ENZYME INHIBITORS | CHROMA THERAPEUTICS LIMITED (GB) | 2004-12-29 | — | — | WO | disclosed |