Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | ADK | P55263 | 1/20 | 0.43 |
| ▸ | F12 | P00748 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 1/20 | 0.43 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11364760 | 0.91 | ADRA2A (0.38) | ADRA2ANISCHMTORADKF12 | |
| SCHEMBL11370414 | 0.91 | ADRA2A (0.38) | ADRA2ANISCHMTORADKF12 | |
| SCHEMBL11366986 | 0.91 | ADRA2A (0.38) | ADRA2ANISCHMTORADKF12 | |
| SCHEMBL27767007 | 0.75 | ADRA2A (0.50) | ADRA2ANISCHMTORADKADRA2B | |
| SCHEMBL10389484 | 0.73 | ADORA3 (0.55) | F12PLAUNCF1NOS3NOS1 | |
| SCHEMBL31595490 | 0.73 | BTK (0.53) | ADRA2ANISCHMTORADKADRA2B | |
| SCHEMBL21298118 | 0.73 | ADRA2A (0.49) | ADRA2ANISCHMTORADKADRA2B | |
| SCHEMBL5312641 | 0.71 | NISCH (0.41) | ADRA2ANISCHMTORADKADRA2B | |
| SCHEMBL18455239 | 0.71 | BTK (0.64) | BTK | |
| Hydrochloric Acid SCHEMBL11360576 | 0.71 | CYP1A1 (0.50) | ADRA2ANISCHMTORADKADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-4269834-A | Copper complexes of isoquinazolines | NAUTA WIJBE T | 1981-05-26 | — | — | US | disclosed |