Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.41 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL8747538 | 0.84 | HTT (0.44) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL8747540 | 0.84 | HTT (0.44) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL16383002 | 0.81 | HTT (0.41) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL24710340 | 0.80 | HTT (0.50) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL13335454 | 0.80 | HTT (0.50) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL28365847 | 0.80 | HTT (0.50) | HTTKDM4EPARP1ALDH1A1HPGD | |
| SCHEMBL1984244 | 0.79 | C1S (0.46) | KDM4EPARP1ALDH1A1MAPTPOLB | |
| SCHEMBL14604983 | 0.79 | CA12 (0.44) | KDM4EPARP1ALDH1A1MAPTGAA | |
| SCHEMBL1984246 | 0.79 | C1S (0.46) | KDM4EPARP1ALDH1A1MAPTPOLB | |
| SCHEMBL15587046 | 0.79 | C1S (0.46) | KDM4EPARP1ALDH1A1MAPTPOLB |
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-7169786-B2 | Isoxazoline derivatives as anti-depressants | JANSSEN-CILAG S.A. (ES) | 2007-01-30 | — | — | US | disclosed |
| US-7169786-B2 | Isoxazoline derivatives as anti-depressants | JANSSEN-CILAG S.A. (ES) | 2007-01-30 | — | — | US | disclosed |