Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.46 |
| ▸ | LMNA | P02545 | 5/20 | 0.46 |
| ▸ | TP53 | P04637 | 4/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KHK | P50053 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL6274969 | 0.83 | ESR1 (0.45) | NPC1RAB9AKDM4EMAPTCYP11B1 | |
| SCHEMBL23399056 | 0.75 | NPC1 (0.51) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL17582162 | 0.74 | NPC1 (0.50) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL4398029 | 0.72 | NPC1 (0.49) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL4401018 | 0.72 | NPC1 (0.56) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL23401021 | 0.72 | NPC1 (0.51) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL30464135 | 0.71 | KHK (0.56) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL22567077 | 0.71 | KHK (0.64) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL2548808 | 0.71 | KHK (0.56) | NPC1RAB9AKDM4EHSD17B10HTT | |
| SCHEMBL23398989 | 0.71 | NPC1 (0.47) | NPC1RAB9AKDM4EHSD17B10HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1551841-A1 | PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS | SmithKline Beecham Corporation (US) | 2005-07-13 | — | — | EP | disclosed |
| WO-2004009602-A1 | PYRAZOLOPYRIMIDINES AS KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-01-29 | — | — | WO | disclosed |