Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.65 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.64 |
| ▸ | PIM1 | P11309 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.59 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.58 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.58 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.53 |
| ▸ | CDK9 | P50750 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8134631 | 1.00 | IKBKB (0.65) | IKBKBMAPK14PIM1KDM4ETDP1 | |
| SCHEMBL28687495 | 0.89 | MAPK14 (0.77) | MAPK14PIM1KDM4ETDP1ADORA1 | |
| SCHEMBL31120375 | 0.85 | ADORA1 (0.78) | MAPK14PIM1KDM4ETDP1HSP90AA1 | |
| SCHEMBL31120351 | 0.84 | ADORA1 (0.83) | MAPK14PIM1KDM4ETDP1ADORA1 | |
| SCHEMBL28931996 | 0.83 | ADORA1 (0.78) | MAPK14PIM1KDM4ETDP1ADORA1 | |
| SCHEMBL31120343 | 0.83 | ADORA1 (0.78) | MAPK14PIM1KDM4ETDP1HSP90AA1 | |
| SCHEMBL31139635 | 0.83 | ADORA1 (0.78) | MAPK14PIM1KDM4ETDP1ADORA1 | |
| SCHEMBL31695349 | 0.82 | IL4 (0.72) | IKBKBPIM1KDM4ETDP1HSP90AA1 | |
| SCHEMBL7498392 | 0.82 | PIM1 (0.76) | IKBKBPIM1KDM4EHSP90AA1HSP90AB1 | |
| SCHEMBL7509621 | 0.81 | KDM4E (0.71) | IKBKBPIM1KDM4ETDP1HSP90AA1 |
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-2000023444-A1 | 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS | ABBOTT LABORATORIES (US) | 2000-04-27 | — | — | WO | disclosed |