Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 5/20 | 0.54 |
| ▸ | DRD2 | P14416 | 5/20 | 0.54 |
| ▸ | DRD4 | P21917 | 5/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.47 |
| ▸ | HTR2C | P28335 | 6/20 | 0.47 |
| ▸ | HRH1 | P35367 | 5/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.47 |
| ▸ | HRH2 | P25021 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7407008 | 0.94 | DRD3 (0.55) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7408671 | 0.85 | DRD3 (0.71) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7416404 | 0.84 | DRD3 (0.53) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7406283 | 0.83 | DRD2 (0.50) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7412847 | 0.81 | DRD2 (0.64) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7407003 | 0.81 | DRD3 (0.55) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7407637 | 0.81 | DRD2 (0.48) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7416400 | 0.81 | DRD3 (0.53) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL7412526 | 0.76 | DRD4 (0.49) | DRD3DRD2DRD4CHRM1LMNA | |
| SCHEMBL6558994 | 0.76 | DRD2 (0.59) | DRD3DRD2DRD4CHRM1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-3962248-A | PROCESS FOR MAKING 11-PIPERAZINO-DIAZEPINES, OXAZEPINES, THIAZEPINES AND AZEPINES | SANDOZ, INC. (US) | 1976-06-08 | — | — | US | disclosed |