Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | AURKA | O14965 | 2/20 | 0.39 |
| ▸ | TEK | Q02763 | 2/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 9/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | USP7 | Q93009 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MET | P08581 | 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 | |
|---|---|---|---|---|
| SCHEMBL7688878 | 1.00 | KDR (0.39) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7688932 | 0.95 | ADRB3 (0.39) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7688930 | 0.95 | ADRB3 (0.39) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7693305 | 0.94 | KDR (0.42) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7693306 | 0.94 | KDR (0.42) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7692428 | 0.93 | ADRB3 (0.37) | KDRAURKATEKLCKADRB3 | |
| SCHEMBL7687573 | 0.91 | ADRB3 (0.36) | KDRADRB3ADRB1CYP2D6CYP2C9 | |
| SCHEMBL7687570 | 0.91 | ADRB3 (0.36) | KDRADRB3ADRB1CYP2D6CYP2C9 | |
| SCHEMBL7694151 | 0.90 | ADRB3 (0.37) | KDRADRB3ADRB1CYP2D6CYP2C9 | |
| SCHEMBL7694153 | 0.90 | ADRB3 (0.37) | KDRADRB3ADRB1CYP2D6CYP2C9 |
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-2002000622-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-01-03 | — | — | WO | disclosed |