Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.48 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | CLK2 | P49760 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8627396 | 0.99 | ADRB2 (0.51) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL8628418 | 0.97 | ADRB2 (0.51) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL9227499 | 0.96 | ADRB2 (0.52) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL8651974 | 0.92 | ADRB2 (0.49) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL8626418 | 0.89 | KCNH2 (0.56) | KCNH2GSK3BKDM4EALDH1A1HPGD | |
| SCHEMBL9229861 | 0.88 | GSK3B (0.46) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL8627127 | 0.87 | GSK3B (0.47) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL9230665 | 0.85 | GSK3B (0.47) | ADRB2KCNH2GSK3BKDM4EALDH1A1 | |
| SCHEMBL8625280 | 0.85 | KCNH2 (0.59) | KCNH2GSK3BKDM4EALDH1A1HPGD | |
| SCHEMBL8628876 | 0.83 | GSK3B (0.48) | ADRB2KCNH2GSK3BKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5776948-A | BACTERICIDE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1998-07-07 | — | — | US | disclosed |
| EP-0664288-A1 | FLUOROQUINOLINE DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1995-07-26 | — | — | EP | disclosed |