Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 3/20 | 0.46 |
| ▸ | MAOA | P21397 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11310023 | 0.82 | MAPT (0.42) | KCNA3MAOACYP3A4CYP1A2TSHR | |
| SCHEMBL11253029 | 0.75 | MAOA (0.59) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL14096644 | 0.75 | MAOA (0.55) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL6993346 | 0.75 | MAOA (0.59) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL11253468 | 0.75 | MAOA (0.55) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL18787936 | 0.72 | CYP3A4 (0.56) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL7001811 | 0.72 | ALDH1A1 (0.52) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL20278771 | 0.69 | CYP3A4 (0.55) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| Xanthotoxol SCHEMBL499269 | 0.67 | CYP3A4 (0.59) | KCNA3MAOACYP3A4CYP2D6CYP2A6 | |
| SCHEMBL8416177 | 0.67 | CYP3A4 (0.64) | KCNA3MAOACYP3A4CYP2D6CYP2A6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4328239-A | 8-Aminoalkylpsoralens | ELDER PHARMACEUTICALS, INC. (US) | 1982-05-04 | — | — | US | disclosed |
| US-4269851-A | 8-Aminoalkyl-4-alkylpsoralens | THOMAS C. ELDER, INC. (US) | 1981-05-26 | — | — | US | disclosed |