Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.45 |
| ▸ | DRD4 | P21917 | 4/20 | 0.45 |
| ▸ | DRD3 | P35462 | 4/20 | 0.45 |
| ▸ | GBA1 | P04062 | 1/20 | 0.43 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | UBE2M | P61081 | 1/20 | 0.39 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL500614 | 0.87 | CXCR4 (0.55) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500579 | 0.87 | CXCR4 (0.55) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500580 | 0.87 | CXCR4 (0.55) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500578 | 0.87 | CXCR4 (0.55) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500743 | 0.87 | CXCR4 (0.55) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500306 | 0.83 | GBA1 (0.49) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500304 | 0.83 | GBA1 (0.49) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL500305 | 0.83 | GBA1 (0.49) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL27602375 | 0.83 | GBA1 (0.49) | DRD2DRD4DRD3GBA1FUCA1 | |
| SCHEMBL13177333 | 0.81 | ACHE (0.46) | DRD2DRD4DRD3GBA1FUCA1 |
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-3181566-A1 | IMIDAZOTRIAZINONE COMPOUNDS | Ironwood Pharmaceuticals, Inc. (US) | 2017-06-21 | — | — | EP | disclosed |