Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 17/20 | 0.49 |
| ▸ | NOS3 | P29474 | 14/20 | 0.49 |
| ▸ | NOS1 | P29475 | 10/20 | 0.49 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8193561 | 0.78 | NOS2 (0.47) | NOS2NOS3NOS1 | |
| SCHEMBL8194949 | 0.72 | NOS2 (0.43) | NOS2NOS3NOS1 | |
| SCHEMBL8063238 | 0.69 | NOS2 (0.60) | NOS2NOS3NOS1DRD2DRD3 | |
| SCHEMBL3842816 | 0.68 | HTR2C (0.51) | NOS2DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL8100806 | 0.68 | NOS2 (0.59) | NOS2NOS3NOS1DRD2DRD3 | |
| SCHEMBL8193657 | 0.67 | NOS2 (0.43) | NOS2NOS3NOS1 | |
| SCHEMBL8193125 | 0.67 | NOS2 (0.58) | NOS2NOS3NOS1 | |
| SCHEMBL8060969 | 0.67 | NOS2 (1.00) | NOS2NOS3NOS1 | |
| SCHEMBL8214849 | 0.66 | NOS3 (1.00) | NOS2NOS3NOS1 | |
| Iodide SCHEMBL8099764 | 0.65 | NOS2 (0.96) | NOS2NOS3NOS1 |
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 |