Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 2/20 | 0.67 |
| ▸ | CNR1 | P21554 | 1/20 | 0.67 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.67 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.67 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.64 |
| ▸ | GABRA5 | P31644 | 6/20 | 0.64 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.64 |
| ▸ | GABRA2 | P47869 | 6/20 | 0.64 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.64 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.64 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | GABRP | O00591 | 2/20 | 0.49 |
| ▸ | GABRD | O14764 | 2/20 | 0.49 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.49 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.49 |
| ▸ | GABRE | P78334 | 2/20 | 0.49 |
| ▸ | GABRA6 | Q16445 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26648747 | 0.87 | PDE4D (0.67) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL7321076 | 0.85 | CHRM1 (0.67) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL7320239 | 0.84 | GABRA1 (0.69) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL7720960 | 0.83 | PDE4D (0.61) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL5034660 | 0.82 | KMT2A (0.76) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL5034758 | 0.82 | KMT2A (0.56) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| Ro-053061 SCHEMBL2615407 | 0.80 | PDE4D (0.71) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL13538415 | 0.80 | PDE4D (0.71) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL1421181 | 0.80 | KMT2A (0.82) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL11821347 | 0.80 | CHRM1 (0.71) | PDE4DCNR1NTSR1OPRK1GABRA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4327026-A | Benzodiazepine derivatives | HOFFMANN-LA ROCHE INC. (US) | 1982-04-27 | — | — | US | disclosed |
| EP-0045452-A2 | Benzodiazepine derivatives, intermediates and their preparation, and pharmaceutical compositions containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-02-10 | — | — | EP | disclosed |