Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.36 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.34 |
| ▸ | GLB1 | P16278 | 1/20 | 0.34 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL294844 | 0.88 | CXCR4 (0.33) | CXCR4GNAO1GLB1GNAI3GNAI1 | |
| SCHEMBL292569 | 0.83 | GNAO1 (0.34) | CXCR4GNAO1GNAI3GNAI1 | |
| SCHEMBL294048 | 0.83 | DRD3 (0.34) | DRD3DRD2DRD1DRD4DRD5 | |
| SCHEMBL294978 | 0.82 | GNAO1 (0.36) | CXCR4GNAO1GNAI3GNAI1 | |
| SCHEMBL13811999 | 0.81 | GLB1 (0.36) | CXCR4GNAO1GLB1GNAI3GNAI1 | |
| SCHEMBL12065816 | 0.80 | GBA1 (0.40) | DRD3GRIN2DGRIN3BTHRBGRIN1 | |
| SCHEMBL3109275 | 0.80 | GLB1 (0.40) | GNAO1GLB1GNAI3GNAI1DRD3 | |
| SCHEMBL27493109 | 0.80 | HRH3 (0.45) | — | |
| SCHEMBL9600348 | 0.79 | S1PR1 (0.35) | CXCR4GNAO1GNAI3GNAI1 | |
| SCHEMBL3093271 | 0.79 | GNAO1 (0.42) | GNAO1GNAI3GNAI1DRD3DRD2 |
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-3055293-B1 | DIARYLALKYLAMINE REV-ERB ANTAGONISTS AND THEIR USE AS MEDICAMENTS | FOND ST ITALIANO TECNOLOGIA (IT) | 2017-12-06 | — | — | EP | disclosed |