Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2871082 | 0.92 | KCNH2 (0.40) | KCNH2HTR2ADRD2HTR2CADORA3 | |
| SCHEMBL2867507 | 0.90 | KDM4E (0.43) | HTR2ADRD2HTR2CADORA3ABCB1 | |
| SCHEMBL2881792 | 0.89 | FGFR1 (0.46) | ADORA3ABCB1ABCC1ABCG2PARP1 | |
| SCHEMBL2863032 | 0.88 | ABCB1 (0.45) | ADORA3ABCB1ABCC1ABCG2PARP1 | |
| SCHEMBL2861092 | 0.77 | ADORA3 (0.53) | ADORA3PARP1ABL1LCKFYN | |
| SCHEMBL13067107 | 0.76 | TDP2 (0.44) | ADORA3PARP1ABL1LCKFYN | |
| SCHEMBL2872710 | 0.75 | ADORA3 (0.57) | ADORA3ABL1LCKFYNLYN | |
| SCHEMBL2877778 | 0.75 | TDP2 (0.49) | ADORA3ABL1LCKFYNLYN | |
| SCHEMBL2858978 | 0.73 | ADORA3 (0.60) | ADORA3 | |
| SCHEMBL2859285 | 0.73 | PTGS2 (0.48) | ADORA3ABL1LCKFYNLYN |
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-7842701-B2 | Pyrazoloquinolone derivative and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-11-30 | — | — | US | disclosed |