Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 4/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.34 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1106976 | 0.88 | CCNA2 (0.40) | ALDH1A1LMNAHSD17B10ADORA1CDK2 | |
| SCHEMBL6388094 | 0.83 | ALDH1A1 (0.34) | ALDH1A1LMNAHSD17B10ADORA1SMN1; SMN2 | |
| SCHEMBL6388050 | 0.81 | KDM5A (0.37) | ALDH1A1LMNAHSD17B10ADORA1KDM4E | |
| SCHEMBL6388056 | 0.81 | KDM5A (0.37) | ALDH1A1LMNAHSD17B10ADORA1KDM4E | |
| SCHEMBL6388085 | 0.81 | CDK2 (0.34) | ALDH1A1LMNAHSD17B10ADORA1KDM4E | |
| SCHEMBL6388090 | 0.81 | CDK2 (0.34) | ALDH1A1LMNAHSD17B10ADORA1KDM4E | |
| SCHEMBL3260157 | 0.80 | ADORA1 (0.39) | ALDH1A1HSD17B10ADORA1SMN1; SMN2KDM4E | |
| SCHEMBL6386568 | 0.78 | ADORA1 (0.33) | ALDH1A1LMNAHSD17B10ADORA1SMN1; SMN2 | |
| SCHEMBL6386570 | 0.78 | ADORA1 (0.33) | ALDH1A1LMNAHSD17B10ADORA1SMN1; SMN2 | |
| SCHEMBL3257731 | 0.78 | L3MBTL1 (0.41) | ALDH1A1LMNAHSD17B10ADORA1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1689721-B1 | AMINOPYRAZOLE DERIVATIVES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2010-07-14 | — | — | EP | claimed |