Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PI4KB | Q9UBF8 | 5/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KIT | P10721 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL655695 | 0.91 | PI4KB (0.81) | PI4KBKCNH2CYP3A4TRPV1MAPT | |
| SCHEMBL655530 | 0.80 | PI4KB (0.85) | PI4KBKCNH2CYP3A4KIT | |
| SCHEMBL656344 | 0.80 | PI4KB (0.84) | PI4KBKCNH2CYP3A4TRPV1KMT2A | |
| SCHEMBL655275 | 0.80 | PI4KB (1.00) | PI4KBKCNH2CYP3A4MAPTKIT | |
| SCHEMBL651916 | 0.78 | PI4KB (0.81) | PI4KBKCNH2CYP3A4KIT | |
| SCHEMBL798137 | 0.76 | PI4KB (0.48) | PI4KBKCNH2CYP3A4MAPTKMT2A | |
| SCHEMBL654265 | 0.75 | PI4KB (0.83) | PI4KBKCNH2CYP3A4KIT | |
| SCHEMBL1694319 | 0.73 | PI4KB (0.60) | PI4KBKCNH2CYP3A4TRPV1MAPT | |
| SCHEMBL16650147 | 0.71 | PI4KB (0.71) | PI4KBKCNH2CYP3A4KITLMNA | |
| SCHEMBL654793 | 0.70 | PI4KB (0.81) | PI4KBKCNH2CYP3A4MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2616077-A1 | ANTI-CANCER ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) | 2013-07-24 | — | — | EP | disclosed |
| WO-2012035423-A1 | ANTI-CANCER ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) | 2012-03-22 | — | — | WO | disclosed |