Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.58 |
| ▸ | JUN | P05412 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9338109 | 0.85 | ABCG2 (0.55) | ABCG2MAPTLMNASMN1; SMN2CYP1A1 | |
| SCHEMBL9337997 | 0.85 | TUBB1 (0.46) | ABCG2JUNNFKB1ATMMAPT | |
| SCHEMBL9338444 | 0.82 | ABCG2 (0.56) | ABCG2SMN1; SMN2CYP1A1CYP1B1CYP1A2 | |
| SCHEMBL9338511 | 0.81 | ABCG2 (0.57) | ABCG2MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL9341976 | 0.80 | TUBB1 (0.48) | ABCG2MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL9338502 | 0.79 | ABCG2 (0.56) | ABCG2ATMMAPTKDM4ELMNA | |
| SCHEMBL9337782 | 0.79 | CYP1A1 (0.45) | ABCG2MAPTKDM4ECYP1A1CYP1B1 | |
| SCHEMBL9339939 | 0.78 | MAOB (0.54) | ABCG2JUNKDM4ELMNACYP1A1 | |
| SCHEMBL9342171 | 0.77 | NFE2L2 (0.56) | MAPTTDP1LMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL9338012 | 0.76 | TUBB1 (0.65) | ABCG2ATMMAPTKDM4ELMNA |
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 4 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-0328669-A1 | CHALCONE DERIVATIVE COMPOUNDS | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-08-23 | — | — | EP | disclosed |
| EP-0328668-A1 | NONLINEAR OPTICAL MATERIAL | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-08-23 | — | — | EP | disclosed |