Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.39 |
| ▸ | TUBB | P07437 | 3/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1942567 | 0.88 | PTPN1 (0.41) | CYP1A2CYP1A1CYP1B1ALDH1A1CYP3A4 | |
| SCHEMBL5203651 | 0.88 | CYP1A2 (0.48) | CYP1A2CYP1A1CYP1B1CYP3A4MAPT | |
| SCHEMBL31090995 | 0.83 | ACHE (0.60) | ALDH1A1CYP3A4MAPTCA9SMN1; SMN2 | |
| SCHEMBL5207796 | 0.83 | CYP3A4 (0.52) | CYP1A2CYP1A1CYP1B1CYP3A4MAPT | |
| SCHEMBL4035679 | 0.82 | CYP1A2 (0.45) | CYP1A2CYP1A1CYP1B1CYP3A4MAPT | |
| SCHEMBL31038744 | 0.81 | CYP3A4 (0.40) | ALDH1A1CYP3A4MAPTCA9SMN1; SMN2 | |
| SCHEMBL4033827 | 0.78 | HSD17B10 (0.46) | ALDH1A1CYP3A4MAPTTUBB4ATUBB | |
| SCHEMBL3592104 | 0.77 | CYP1A2 (0.46) | CYP1A2CYP1A1CYP1B1ALDH1A1CYP3A4 | |
| SCHEMBL5207737 | 0.77 | ALDH1A1 (0.58) | CYP1A2CYP1A1CYP1B1ALDH1A1CYP3A4 | |
| SCHEMBL1614223 | 0.76 | PTGS2 (0.42) | CYP3A4MAPTERN1TUBB4ATUBB |
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-1403250-B1 | BIS(5-ARYL-2-PYRIDYL) DERIVATIVE | KOWA CO (JP) | 2007-07-18 | — | — | EP | disclosed |
| EP-1403251-B1 | BIS(2-ARYL-5-PYRIDYL) DERIVATIVE | KOWA CO (JP) | 2007-07-18 | — | — | EP | disclosed |
| EP-1403250-A1 | BIS(5-ARYL-2-PYRIDYL) DERIVATIVE | Kowa Co., Ltd. (JP) | 2004-03-31 | — | — | EP | disclosed |
| EP-1403251-A1 | BIS(2-ARYL-5-PYRIDYL) DERIVATIVE | Kowa Co., Ltd. (JP) | 2004-03-31 | — | — | EP | disclosed |