Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 7/20 | 0.40 |
| ▸ | NOS1 | P29475 | 6/20 | 0.40 |
| ▸ | NOS3 | P29474 | 4/20 | 0.40 |
| ▸ | DDAH1 | O94760 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ARG2 | P78540 | 4/20 | 0.40 |
| ▸ | ARG1 | P05089 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL191235 | 0.90 | NOS3 (0.41) | GSRNOS2NOS1NOS3KMT2A | |
| SCHEMBL191236 | 0.90 | NOS3 (0.41) | GSRNOS2NOS1NOS3KMT2A | |
| SCHEMBL490891 | 0.90 | NOS3 (0.41) | GSRNOS2NOS1NOS3KMT2A | |
| SCHEMBL13639864 | 0.88 | SLC1A1 (0.55) | — | |
| SCHEMBL9989984 | 0.81 | GPR84 (0.43) | — | |
| SCHEMBL9989980 | 0.81 | GPR84 (0.43) | — | |
| SCHEMBL10314812 | 0.79 | NOS3 (0.38) | NOS2NOS1NOS3CYP2C19MEN1 | |
| SCHEMBL20591675 | 0.79 | NOS3 (0.38) | NOS2NOS1NOS3CYP2C19MEN1 | |
| SCHEMBL7082396 | 0.78 | TDP1 (0.34) | MEN1KMT2A | |
| SCHEMBL18019367 | 0.76 | SLC1A2 (0.33) | NOS2NOS1NOS3MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112351781-A | Imidazodiazepine diones and methods of use thereof | 金翅雀生物公司 | 2021-02-09 | — | — | CN | disclosed |