Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.44 |
| ▸ | NOS2 | P35228 | 13/20 | 0.41 |
| ▸ | NOS3 | P29474 | 9/20 | 0.41 |
| ▸ | NOS1 | P29475 | 5/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8215252 | 0.84 | TAAR1 (0.50) | TAAR1NOS2NOS3NOS1 | |
| SCHEMBL8194863 | 0.80 | NOS2 (0.47) | NOS2NOS3NOS1 | |
| SCHEMBL8193587 | 0.80 | NOS2 (0.47) | NOS2NOS3NOS1 | |
| SCHEMBL8193125 | 0.78 | NOS2 (0.58) | NOS2NOS3NOS1 | |
| SCHEMBL8186361 | 0.76 | NOS2 (0.61) | TAAR1NOS2NOS3NOS1NPC1 | |
| SCHEMBL8197854 | 0.76 | NOS2 (0.54) | NOS2NOS3NOS1 | |
| SCHEMBL6191572 | 0.75 | TAAR1 (0.51) | TAAR1NOS2NOS3NOS1HDAC3 | |
| SCHEMBL6994968 | 0.75 | TAAR1 (0.51) | TAAR1NOS2NOS3NOS1HDAC3 | |
| Hydrochloric Acid SCHEMBL6752220 | 0.73 | TAAR1 (0.50) | TAAR1NOS2NOS3NOS1HDAC3 | |
| SCHEMBL8216232 | 0.73 | TAAR1 (0.39) | TAAR1NOS2NOS3NOS1HDAC3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000064904-A1 | 5,7-BICYCLIC AMIDINE DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | ASTRAZENECA AB (SE) | 2000-11-02 | — | — | WO | claimed |
| WO-2000064904-A1 | 5,7-BICYCLIC AMIDINE DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | ASTRAZENECA AB (SE) | 2000-11-02 | — | — | WO | disclosed |