Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.49 |
| ▸ | IKBKB | O14920 | 3/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | ERO1A | Q96HE7 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7051467 | 0.90 | CHEK1 (0.56) | NPC1RAB9ANPSR1KDM4EMAPT | |
| SCHEMBL7058742 | 0.89 | IKBKB (0.64) | IKBKBCHEK1JAK2JAK3 | |
| SCHEMBL7059399 | 0.78 | PTPN1 (0.53) | NPC1RAB9ANPSR1KDM4EMAPT | |
| SCHEMBL7052328 | 0.76 | CHEK1 (0.78) | NPC1RAB9ANPSR1KDM4EMAPT | |
| SCHEMBL5898667 | 0.75 | IKBKB (0.74) | IKBKBCHEK1MAP4K4JAK2JAK3 | |
| SCHEMBL7058327 | 0.74 | IKBKB (0.58) | IKBKBCHEK1MAP4K4JAK2JAK3 | |
| SCHEMBL5898642 | 0.74 | IKBKB (0.58) | IKBKBCHEK1MAP4K4JAK2JAK3 | |
| SCHEMBL7055995 | 0.74 | CHEK1 (0.62) | NPC1RAB9ANPSR1MAPTPTPN5 | |
| SCHEMBL7055932 | 0.74 | CHEK1 (0.59) | NPC1RAB9ANPSR1KDM4EMAPT | |
| SCHEMBL5898657 | 0.73 | IKBKB (0.76) | IKBKBCHEK1MAP4K4JAK2JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003029241-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | claimed |