Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10075481 | 0.74 | BRD4 (0.46) | HSD17B3MEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL6988456 | 0.72 | HSD17B3 (0.69) | HSD17B3MEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2784147 | 0.71 | NPC1 (0.51) | MEN1ALDH1A1MAPTKMT2AMAOA | |
| SCHEMBL22401867 | 0.70 | MAOA (0.39) | HSD17B3MEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL25650200 | 0.70 | MAOA (0.39) | HSD17B3MEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2767357 | 0.67 | NPC1 (0.59) | HSD17B3ALDH1A1MAPTMAOBKDM4E | |
| SCHEMBL3622244 | 0.67 | ALDH1A1 (0.49) | MEN1ALDH1A1MAPTCYP2C19KMT2A | |
| SCHEMBL2767899 | 0.67 | TSHR (0.45) | MEN1CYP3A4CYP2D6CYP2C19KMT2A | |
| Caroxazone SCHEMBL5058621 | 0.66 | PARP1 (0.37) | MEN1ALDH1A1MAPTALOX15CYP2C19 | |
| Caroxazone SCHEMBL30020763 | 0.66 | PARP1 (0.37) | MEN1ALDH1A1MAPTALOX15CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011143444-A2 | DIPHENYLBUTYPIPERIDINE AUTOPHAGY INDUCERS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2011-11-17 | — | — | WO | disclosed |