Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDR1 | Q08345 | 1/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ESRRA | P11474 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12426560 | 0.81 | DDR1 (0.46) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL272847 | 0.80 | NR1H2 (0.63) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL6014057 | 0.80 | DDR1 (0.46) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL21974754 | 0.79 | NR1H2 (0.65) | DDR1NR1H2ALDH1A1KMT2A | |
| SCHEMBL3557511 | 0.79 | DDR1 (0.56) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL272846 | 0.78 | DDR1 (0.55) | DDR1NR1H2NOS3NOS1NOS2 | |
| Hydrochloric Acid SCHEMBL3555518 | 0.77 | DDR1 (0.57) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL19073475 | 0.75 | DDR1 (0.53) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL19072901 | 0.75 | DDR1 (0.51) | DDR1NR1H2NOS3NOS1NOS2 | |
| SCHEMBL29958951 | 0.75 | DDR1 (0.49) | DDR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3299358-A1 | AMIDE DERIVATIVE AND MEDICINE | Nippon Shinyaku Co., Ltd. (JP) | 2018-03-28 | — | — | EP | disclosed |
| EP-1702917-B1 | AMIDE DERIVATIVE AND MEDICINE | NIPPON SHINYAKU CO LTD (JP) | 2017-08-02 | — | — | EP | disclosed |
| EP-1702917-A1 | AMIDE DERIVATIVE AND MEDICINE | Nippon Shinyaku Co., Ltd. (JP) | 2006-09-20 | — | — | EP | disclosed |