Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL654709 | 0.91 | PI4KB (0.59) | PI4KBCYP3A4KCNH2LMNACYP2D6 | |
| SCHEMBL798314 | 0.76 | PI4KB (0.67) | PI4KBCYP3A4KCNH2LMNAKMT2A | |
| SCHEMBL655854 | 0.70 | PI4KB (0.85) | PI4KBCYP3A4KCNH2LMNACYP2C19 | |
| SCHEMBL1694319 | 0.69 | PI4KB (0.60) | PI4KBCYP3A4KCNH2LMNACYP2D6 | |
| SCHEMBL16650147 | 0.69 | PI4KB (0.71) | PI4KBCYP3A4KCNH2LMNACYP1A2 | |
| SCHEMBL655695 | 0.67 | PI4KB (0.81) | PI4KBCYP3A4KCNH2KMT2AMEN1 | |
| SCHEMBL15124766 | 0.67 | PI4KB (0.56) | PI4KBCYP3A4KCNH2LMNAPTGS2 | |
| SCHEMBL655530 | 0.67 | PI4KB (0.85) | PI4KBCYP3A4KCNH2PDGFRB | |
| SCHEMBL655275 | 0.65 | PI4KB (1.00) | PI4KBCYP3A4KCNH2ALDH1A1SMN1; SMN2 | |
| SCHEMBL655972 | 0.65 | PI4KB (0.69) | PI4KBCYP3A4KCNH2SMN1; SMN2MAPT |
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 | claimed |
| WO-2012035423-A1 | ANTI-CANCER ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) | 2012-03-22 | — | — | WO | claimed |