Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 2/20 | 0.61 |
| ▸ | CNR1 | P21554 | 1/20 | 0.61 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.61 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.61 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.59 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.59 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.59 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.59 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.59 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.59 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.47 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.47 |
| ▸ | MDH2 | P40926 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9654320 | 0.85 | GABRA1 (0.66) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL4709615 | 0.81 | PDE4D (0.67) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL11821347 | 0.79 | CHRM1 (0.71) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL11776007 | 0.78 | PDE4D (0.70) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL15198055 | 0.78 | EGFR (0.50) | GABRA5GABRA3GABRG2GABRB3HPGD | |
| SCHEMBL9654207 | 0.77 | PDE4D (0.61) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL5349947 | 0.77 | GABRA1 (0.62) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL1421181 | 0.76 | KMT2A (0.82) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| SCHEMBL13538415 | 0.76 | PDE4D (0.71) | PDE4DCNR1NTSR1OPRK1GABRA1 | |
| Ro-053061 SCHEMBL2615407 | 0.76 | PDE4D (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0255028-A2 | 1,4-Benzodiazepines, their preparation and use as PAF antagonists | BOEHRINGER INGELHEIM KG (DE) | 1988-02-03 | — | — | EP | disclosed |