Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.97 |
| ▸ | MAOA | P21397 | 3/20 | 0.97 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.97 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.97 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.97 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.97 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.97 |
| ▸ | TSHR | P16473 | 1/20 | 0.97 |
| ▸ | ACHE | P22303 | 1/20 | 0.97 |
| ▸ | PDE4A | P27815 | 1/20 | 0.97 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.97 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.97 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.68 |
| ▸ | POLB | P06746 | 2/20 | 0.68 |
| ▸ | MAPT | P10636 | 2/20 | 0.68 |
| ▸ | MAOB | P27338 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | HPGD | P15428 | 5/20 | 0.60 |
| ▸ | CA9 | Q16790 | 5/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Methoxsalen SCHEMBL2302069 | 0.98 | CYP3A4 (1.00) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Methoxsalen SCHEMBL19168 | 0.98 | CYP3A4 (1.00) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Methoxsalen SCHEMBL29376525 | 0.98 | CYP3A4 (1.00) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Methoxsalen SCHEMBL9387169 | 0.91 | CYP3A4 (0.86) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Methoxsalen SCHEMBL10572509 | 0.90 | CYP3A4 (0.84) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Methoxsalen SCHEMBL598765 | 0.89 | CYP3A4 (0.82) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| Bergapten SCHEMBL9792363 | 0.85 | CYP3A4 (0.74) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| SCHEMBL7781220 | 0.82 | CYP3A4 (0.72) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| SCHEMBL8806449 | 0.82 | CYP3A4 (0.71) | CYP3A4MAOACYP1A2CYP2A6MAPK1 | |
| SCHEMBL13660657 | 0.82 | CYP3A4 (0.71) | CYP3A4MAOACYP1A2CYP2A6MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1567134-A2 | PHARMACEUTICAL COMPOSITIONS COMPRISING A BASIC RESPECTIVELY ACIDIC DRUG COMPOUND, A SURFACTANT AND A PHYSIOLOGICALLY TOLERABLE WATER-SOLUBLE ACID RESPECTIVELY BASE | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004050068-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING A BASIC RESPECTIVELY ACIDIC DRUG COMPOUND, A SURFACTANT AND A PHYSIOLOGICALLY TOLERABLE WATER-SOLUBLE ACID RESPECTIVELY BASE | JANSSEN PHARMACEUTICA N.V. (BE) | 2004-06-17 | — | — | WO | disclosed |
| WO-2004050058-A2 | PHARMACEUTICAL COMPOSITIONS COMPRISING A BASIC RESPECTIVELY ACIDIC DRUG COMPOUND, A SURFACTANT AND A PHYSIOLOGICALLY TOLERABLE WATER-SOLUBLE ACID RESPECTIVELY BASE | JANSSEN PHARMACEUTICA N.V. (BE) | 2004-06-17 | — | — | WO | disclosed |
| EP-0998304-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLODEXTRINS | JANSSEN PHARMACEUTICA N.V. (BE) | 2000-05-10 | — | — | EP | disclosed |
| WO-1998055148-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING CYCLODEXTRINS | JANSSEN PHARMACEUTICA N.V. (BE) | 1998-12-10 | — | — | WO | disclosed |