Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22437161 | 0.87 | CYP2D6 (0.40) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL15800261 | 0.86 | HTR1D (0.44) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL21531653 | 0.84 | CYP2D6 (0.42) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL10211670 | 0.84 | KLF10 (0.50) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL9154420 | 0.84 | NPC1 (0.39) | ALDH1A1KLF10MEN1MAPTKMT2A | |
| SCHEMBL21449928 | 0.82 | CYP2D6 (0.41) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL28863770 | 0.81 | CYP2D6 (0.61) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL18854449 | 0.79 | CYP2D6 (0.44) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL25574426 | 0.79 | ESR1 (0.40) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL24325443 | 0.79 | CYP2D6 (0.42) | CYP2D6ALDH1A1HPGDALOX15HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0513577-B1 | Method for the preparation of 1-alkoxyisochromans | BASF AG (DE) | 1995-01-18 | — | — | EP | disclosed |
| EP-0513577-A1 | Method for the preparation of 1-alkoxyisochromans | BASF Aktiengesellschaft (DE) | 1992-11-19 | — | — | EP | disclosed |