Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAP2 | P11137 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27908888 | 0.89 | KEAP1 (0.47) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL9231630 | 0.81 | DRD2 (0.44) | KEAP1NFE2L2KDM4EMAP2GABRA1 | |
| SCHEMBL2730323 | 0.78 | ALDH1A1 (0.59) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL6583063 | 0.73 | TUBB4A (0.51) | KEAP1NFE2L2KDM4EALDH1A1HPGD | |
| SCHEMBL15101537 | 0.73 | TSHR (0.52) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL7371534 | 0.72 | KDM4E (0.50) | KEAP1NFE2L2KDM4EMAPTALDH1A1 | |
| SCHEMBL2730512 | 0.72 | MAP2 (0.61) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL14255879 | 0.72 | KMT2A (0.55) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL30356394 | 0.71 | MAPT (0.55) | KEAP1NFE2L2KIF11KDM4EMAPT | |
| SCHEMBL10067335 | 0.71 | MAPT (0.55) | KEAP1NFE2L2KIF11KDM4EMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0655440-A2 | 1-Aminoethylindoles | F. HOFFMANN-LA ROCHE AG (CH) | 1995-05-31 | — | — | EP | disclosed |