Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHCY | P23526 | 4/20 | 0.73 |
| ▸ | ADORA3 | P0DMS8 | 10/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.53 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.53 |
| ▸ | PDE2A | O00408 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | PNP | P00491 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL9213189 | 1.00 | AHCY (0.73) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9221061 | 0.88 | AHCY (0.70) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9221056 | 0.88 | AHCY (0.70) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9214858 | 0.84 | AHCY (1.00) | AHCYADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL9216846 | 0.84 | AHCY (1.00) | AHCYADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL9214869 | 0.84 | AHCY (1.00) | AHCYADORA3ADORA2AADORA1SMN1; SMN2 | |
| SCHEMBL9213287 | 0.75 | ADORA3 (0.57) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9213295 | 0.75 | ADORA3 (0.57) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9219837 | 0.73 | AHCY (0.67) | AHCYADORA3ADORA2AADORA1PDE4D | |
| SCHEMBL9219846 | 0.73 | AHCY (0.67) | AHCYADORA3ADORA2AADORA1PDE4D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0347852-B1 | Novel neplanocin derivatives | MERRELL DOW PHARMA (US) | 1995-08-23 | — | — | EP | claimed |
| EP-0347852-A2 | Novel neplanocin derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-12-27 | — | — | EP | claimed |
| EP-0347852-B1 | Novel neplanocin derivatives | MERRELL DOW PHARMA (US) | 1995-08-23 | — | — | EP | disclosed |
| EP-0347852-A2 | Novel neplanocin derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-12-27 | — | — | EP | disclosed |