Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 3/20 | 0.64 |
| ▸ | OGG1 | O15527 | 1/20 | 0.54 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ACP1 | P24666 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14262930 | 0.77 | PDE5A (0.85) | PDE5AOGG1NPY5RTP53TSHR | |
| SCHEMBL14262923 | 0.75 | PDE5A (0.82) | PDE5AOGG1NPY5RTP53TSHR | |
| SCHEMBL7127226 | 0.75 | HRH4 (0.53) | PDE5ATSHRHTTLMNASMN1; SMN2 | |
| SCHEMBL4094738 | 0.73 | PDE5A (0.70) | PDE5AOGG1NPY5RSMN1; SMN2ADORA3 | |
| SCHEMBL6700628 | 0.73 | ABCG2 (0.56) | PDE5ATP53L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL28054407 | 0.72 | PDE5A (0.63) | PDE5AOGG1NPSR1ATMTP53 | |
| SCHEMBL786840 | 0.71 | PDE5A (0.62) | PDE5AOGG1NPY5RNPSR1ATM | |
| SCHEMBL4095293 | 0.70 | PDE5A (1.00) | PDE5AOGG1NPSR1ATMLMNA | |
| SCHEMBL7124846 | 0.70 | NPY5R (0.57) | NPY5RTP53TSHRSMN1; SMN2 | |
| SCHEMBL14262834 | 0.70 | PDE5A (0.72) | PDE5AOGG1NPY5RTP53TSHR |
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-7390815-B2 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-06-24 | — | — | US | disclosed |
| US-20040116454-A1 | Pyrazole compounds useful as protein kinase inhibitors | VERTEX PHARMACEUTICALS INCORPORATED | 2004-06-17 | — | — | US | disclosed |