Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.40 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4728986 | 1.00 | EGFR (0.45) | EGFRATMPDPK1RAB9AABCB1 | |
| SCHEMBL4729633 | 0.91 | EGFR (0.51) | EGFRATMRAB9AABCB1CYP3A4 | |
| SCHEMBL4726716 | 0.90 | RAB9A (0.46) | EGFRATMRAB9AABCB1CYP3A4 | |
| SCHEMBL4728717 | 0.80 | RAB9A (0.52) | RAB9APDE10ATP53HTTMAPT | |
| SCHEMBL4725061 | 0.79 | ATM (0.57) | EGFRATMPDPK1CYP3A4PDE10A | |
| SCHEMBL4728463 | 0.79 | PDPK1 (0.46) | ATMPDPK1PDE10APDGFRBPDGFRA | |
| SCHEMBL4725063 | 0.79 | PDPK1 (0.46) | ATMPDPK1PDE10APDGFRBPDGFRA | |
| SCHEMBL4725516 | 0.75 | PDE10A (0.49) | ATMPDPK1PDE10APDGFRBPDGFRA | |
| SCHEMBL4728978 | 0.75 | PDE10A (0.49) | ATMPDPK1PDE10APDGFRBPDGFRA | |
| SCHEMBL4728758 | 0.75 | RAB9A (0.53) | RAB9APDE10ATP53HTTMAPT |
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-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | claimed |