Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 8/20 | 0.79 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.56 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.56 |
| ▸ | PDE2A | O00408 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28567891 | 0.92 | PDE5A (0.67) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL29408532 | 0.92 | PDE5A (0.67) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL290507 | 0.92 | PDE5A (0.67) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL29408482 | 0.89 | PDE5A (0.85) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL28567178 | 0.89 | PDE5A (0.85) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL29408509 | 0.88 | PDE5A (1.00) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL28564661 | 0.88 | PDE5A (1.00) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL6068495 | 0.88 | PDE5A (0.84) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL29831637 | 0.88 | PDE5A (0.84) | PDE5APDE3BPDE3APDE2AALDH1A1 | |
| SCHEMBL6068200 | 0.88 | PDE5A (0.64) | PDE5APDE3BPDE3APDE2AALDH1A1 |
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-7087614-B2 | Pyrimidine inhibitors of phosphodiesterase (PDE) 7 | BRISTOL-MYERS SQUIBB CO. (US) | 2006-08-08 | — | — | US | disclosed |