Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.46 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13689397 | 0.85 | CXCR4 (0.43) | CXCR4CASP1CTSLCTSSCTSK | |
| SCHEMBL13691767 | 0.83 | DRD3 (0.56) | DRD2DRD3SLC6A2SLC6A4DRD4 | |
| SCHEMBL22545910 | 0.74 | HDAC3 (0.50) | DRD2DRD3SLC6A2SLC6A4OPRM1 | |
| SCHEMBL13691766 | 0.73 | DRD3 (0.50) | DRD2DRD3SLC6A2SLC6A4DRD4 | |
| SCHEMBL13691798 | 0.72 | SMYD2 (0.47) | DRD2DRD3 | |
| SCHEMBL13691769 | 0.71 | OPRM1 (0.46) | DRD2DRD3OPRM1TMEM97SIGMAR1 | |
| SCHEMBL13691772 | 0.70 | OPRM1 (0.46) | DRD2DRD3OPRM1TMEM97SIGMAR1 | |
| SCHEMBL22545937 | 0.70 | CHRM2 (0.48) | DRD2DRD3OPRM1TMEM97SIGMAR1 | |
| SCHEMBL13691765 | 0.69 | NPC1 (0.44) | CPB2DRD2DRD3OPRM1TMEM97 | |
| SCHEMBL13689401 | 0.68 | OPRM1 (0.45) | DRD2DRD3OPRM1TMEM97SIGMAR1 |
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-2010096853-A1 | METHODS OF MODULATING THE ACTIVITY OF THE MC1 RECEPTOR AND TREATMENT OF CONDITIONS RELATED TO THIS RECEPTOR | MIMETICA PTY LTD (AU) | 2010-09-02 | — | — | WO | disclosed |