Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K8 | P41279 | 7/20 | 0.38 |
| ▸ | PDE5A | O76074 | 5/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.31 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3371279 | 1.00 | MAP3K8 (0.38) | MAP3K8PDE5AHDAC3HDAC1HDAC2 | |
| SCHEMBL3371277 | 1.00 | MAP3K8 (0.38) | MAP3K8PDE5AHDAC3HDAC1HDAC2 | |
| SCHEMBL13069299 | 0.86 | P2RX7 (0.35) | CISD1VNN1 | |
| SCHEMBL3370868 | 0.86 | P2RX7 (0.35) | CISD1VNN1 | |
| SCHEMBL3372598 | 0.85 | VNN1 (0.39) | PDE5AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL13069006 | 0.85 | VNN1 (0.39) | PDE5AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL3372593 | 0.85 | VNN1 (0.39) | PDE5AHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL5571297 | 0.84 | GRM4 (0.41) | HDAC3HDAC1HDAC2HDAC6EGFR | |
| SCHEMBL5571291 | 0.84 | GRM4 (0.41) | HDAC3HDAC1HDAC2HDAC6EGFR | |
| SCHEMBL3371539 | 0.82 | ABL1 (0.35) | PDE5AMAPK1CISD1VNN1 |
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-7304074-B2 | Substituted 1,5-naphthyridine azolinones | HOFFMANN-LA ROCHE INC. (US) | 2007-12-04 | — | — | US | disclosed |
| US-7304074-B2 | Substituted 1,5-naphthyridine azolinones | HOFFMANN-LA ROCHE INC. (US) | 2007-12-04 | — | — | US | disclosed |