Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | JAK2 | O60674 | 4/20 | 0.38 |
| ▸ | JAK3 | P52333 | 4/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | CBFB | Q13951 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13841926 | 0.90 | KDR (0.44) | KDRGRM5PIK3CGALDH1A1HPGD | |
| SCHEMBL13178371 | 0.88 | KDR (0.55) | KDRALDH1A1HPGDHSD17B10MAOB | |
| SCHEMBL13178372 | 0.86 | NPC1 (0.50) | KDRGRM5ALDH1A1MAOBLMNA | |
| SCHEMBL13841922 | 0.85 | MAOB (0.47) | KDRGRM5PIK3CGALDH1A1HPGD | |
| SCHEMBL13178263 | 0.85 | MAOB (0.53) | KDRALDH1A1MAOBJAK2JAK3 | |
| SCHEMBL13841984 | 0.83 | AKT2 (0.42) | KDRPIK3CGALDH1A1HPGDHSD17B10 | |
| SCHEMBL5616970 | 0.83 | KDR (0.48) | KDRGRM5MAOBATRRET | |
| SCHEMBL13178264 | 0.82 | KDR (0.44) | KDRGRM5ALDH1A1MAOBJAK2 | |
| SCHEMBL13178422 | 0.82 | KDR (0.44) | KDRGRM5ALDH1A1MAOBJAK2 | |
| SCHEMBL13841941 | 0.82 | KDR (0.46) | KDRGRM5ALDH1A1MAOBJAK2 |
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-7528138-B2 | Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-05 | — | — | US | disclosed |
| US-7528138-B2 | Pyrazolo[1,5-a]pyrimidines useful as inhibitors of protein kinases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-05-05 | — | — | US | disclosed |