Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 5/20 | 0.54 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | FOS | P01100 | 1/20 | 0.48 |
| ▸ | JUN | P05412 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337782 | 0.88 | CYP1A1 (0.45) | MAOBCYP1A1CYP1A2CYP2D6CYP1B1 | |
| SCHEMBL10497360 | 0.86 | MAOB (0.48) | MAOBBCHECYP1A1CYP1A2CYP2D6 | |
| SCHEMBL9339814 | 0.85 | MAOB (0.58) | MAOBBCHECYP1A1CYP1A2CYP2D6 | |
| SCHEMBL9337818 | 0.85 | HDAC4 (0.45) | MAOBMAOAKDM4EMEN1KMT2A | |
| SCHEMBL9338665 | 0.82 | SLC6A19 (0.51) | MAOBCYP1A1CYP1A2CYP2D6CYP1B1 | |
| SCHEMBL9779017 | 0.82 | MAOB (0.48) | MAOBMAOARELAKDM4EMEN1 | |
| SCHEMBL9338586 | 0.81 | NPSR1 (0.48) | MAOBCYP1B1MAOAKDM4EMEN1 | |
| SCHEMBL9338406 | 0.80 | BCL2 (0.43) | BCHERELA | |
| SCHEMBL9338680 | 0.80 | HDAC4 (0.39) | MAOBMAOAKDM4EKMT2ALMNA | |
| SCHEMBL9338502 | 0.80 | ABCG2 (0.56) | CYP1A1CYP1A2CYP2D6CYP1B1KDM4E |
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-0328668-B1 | NONLINEAR OPTICAL MATERIAL | NIPPON OILS & FATS CO LTD (JP) | 1994-05-25 | — | — | EP | disclosed |
| US-5045239-A | Chalcone derivative | NIPPON OIL AND FATS CO., LTD. (JP) | 1991-09-03 | — | — | US | disclosed |
| EP-0328668-A1 | NONLINEAR OPTICAL MATERIAL | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-08-23 | — | — | EP | disclosed |