Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 11/20 | 0.37 |
| ▸ | TYMP | P19971 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6090133 | 1.00 | ALK (0.41) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6093034 | 0.82 | ALK (0.40) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6093035 | 0.82 | ALK (0.40) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6090470 | 0.81 | ALK (0.40) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6090474 | 0.81 | ALK (0.40) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6088628 | 0.80 | PDPK1 (0.44) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6088625 | 0.80 | PDPK1 (0.44) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6090038 | 0.77 | SIRT1 (0.47) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6090044 | 0.77 | SIRT1 (0.47) | ALKMAPTALDH1A1LMNAHSP90AA1 | |
| SCHEMBL6088833 | 0.76 | ALK (0.40) | ALKMAPTALDH1A1LMNAHSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |