Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | MTOR | P42345 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | BLM | P54132 | 2/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 10/20 | 0.49 |
| ▸ | DRD2 | P14416 | 9/20 | 0.49 |
| ▸ | HTR2A | P28223 | 8/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 8/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.49 |
| ▸ | HRH1 | P35367 | 7/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL904909 | 0.95 | CYP3A4 (0.57) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904873 | 0.91 | DRD2 (0.54) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904872 | 0.90 | CYP3A4 (0.55) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904871 | 0.90 | DRD2 (0.58) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904880 | 0.88 | TACR3 (0.54) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904936 | 0.86 | CYP2C19 (0.63) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904929 | 0.84 | TACR3 (0.55) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904932 | 0.84 | DRD3 (0.57) | CYP3A4CYP2D6MAPK1MTORRAB9A | |
| SCHEMBL904920 | 0.82 | DRD2 (0.65) | CYP3A4CYP2D6DRD3DRD2HTR2A | |
| SCHEMBL904881 | 0.82 | OPRM1 (0.73) | CYP3A4CYP2D6MAPK1MTORRAB9A |
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 |