Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5805878 | 0.84 | POLB (0.46) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL7822949 | 0.81 | NOS3 (0.50) | POLBALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL2788543 | 0.80 | CNR1 (0.72) | CNR1CNR2POLBKDM4E | |
| SCHEMBL8338047 | 0.77 | ALDH1A1 (0.66) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL5373340 | 0.77 | POLB (0.49) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL2426365 | 0.76 | KDM4E (0.54) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL1596772 | 0.76 | ALDH1A1 (0.50) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL4708254 | 0.75 | GAA (0.51) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL3566534 | 0.74 | MEN1 (0.50) | CNR1CNR2POLBALDH1A1MAPT | |
| SCHEMBL4953382 | 0.73 | CNR1 (0.69) | CNR1CNR2POLBKDM4E |
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-6242453-B1 | Polycyclo heterocyclic derivatives as antiinflammatory agents | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC | 2001-06-05 | — | — | US | disclosed |