Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | NOS2 | P35228 | 16/20 | 0.39 |
| ▸ | NOS3 | P29474 | 10/20 | 0.39 |
| ▸ | NOS1 | P29475 | 6/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8207387 | 0.80 | NOS2 (0.54) | NOS2NOS3NOS1 | |
| SCHEMBL8186402 | 0.73 | TAAR1 (0.44) | TAAR1NOS2NOS3NOS1MAPT | |
| SCHEMBL8215252 | 0.61 | TAAR1 (0.50) | TAAR1NOS2NOS3NOS1MEN1 | |
| SCHEMBL10551350 | 0.60 | TAAR1 (0.51) | TAAR1NOS2NOS3NOS1 | |
| SCHEMBL6191572 | 0.60 | TAAR1 (0.51) | TAAR1NOS2NOS3NOS1MEN1 | |
| SCHEMBL6994968 | 0.60 | TAAR1 (0.51) | TAAR1NOS2NOS3NOS1MEN1 | |
| SCHEMBL22206479 | 0.59 | BACE1 (0.46) | ALDH1A1MAPTHSD17B10 | |
| Hydrochloric Acid SCHEMBL6752220 | 0.59 | TAAR1 (0.50) | TAAR1NOS2NOS3NOS1MEN1 | |
| SCHEMBL27458719 | 0.58 | NOS1 (0.55) | TAAR1NOS2NOS3NOS1MEN1 | |
| SCHEMBL27458720 | 0.58 | NOS1 (0.55) | TAAR1NOS2NOS3NOS1MEN1 |
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-2000064904-A1 | 5,7-BICYCLIC AMIDINE DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | ASTRAZENECA AB (SE) | 2000-11-02 | — | — | WO | disclosed |