Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.66 |
| ▸ | TNKS | O95271 | 3/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KDM4A | O75164 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL46306 | 0.87 | TDP1 (0.65) | TDP1HRH3SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL30341672 | 0.87 | TDP1 (0.65) | TDP1HRH3SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL10329801 | 0.87 | TDP1 (0.65) | TDP1HRH3SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL16408483 | 0.85 | TDP1 (0.63) | TDP1HRH3SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL16546002 | 0.85 | TDP1 (0.63) | TDP1HRH3SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL2377708 | 0.83 | POLB (0.54) | TDP1TNKSHRH4HRH3SMN1; SMN2 | |
| SCHEMBL3398915 | 0.83 | CCR8 (0.48) | TDP1TNKSHRH4SMN1; SMN2L3MBTL1 | |
| SCHEMBL7877444 | 0.83 | SMN1; SMN2 (0.70) | TDP1SMN1; SMN2PDE10AMTORNPC1 | |
| SCHEMBL12286062 | 0.83 | TDP1 (0.60) | TDP1HRH4SMN1; SMN2L3MBTL1PDE10A | |
| SCHEMBL25498357 | 0.81 | SMN1; SMN2 (0.56) | TDP1TNKSHRH4SMN1; SMN2L3MBTL1 |
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-2018086589-A1 | 1,5,7-TRI-SUBSTITUTED ISOQUINOLINE DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN MEDICINES | 上海海雁医药科技有限公司 | 2018-05-17 | — | — | WO | disclosed |