Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 4/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | P2RY12 | Q9H244 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.39 |
| ▸ | STAT3 | P40763 | 3/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL653372 | 0.91 | CNR2 (0.48) | CNR2GPR55P2RY12KDM4EALDH1A1 | |
| SCHEMBL655170 | 0.90 | CNR2 (0.48) | CNR2GPR55KDM4EALDH1A1CNR1 | |
| SCHEMBL653833 | 0.77 | ALDH1A1 (0.52) | CNR2GPR55KDM4EALDH1A1CNR1 | |
| SCHEMBL656257 | 0.75 | GFER (0.53) | CNR2GPR55P2RY12KDM4EALDH1A1 | |
| SCHEMBL655251 | 0.75 | L3MBTL1 (0.46) | CNR2GPR55P2RY12KDM4EALDH1A1 | |
| SCHEMBL654795 | 0.74 | ENPP2 (0.52) | CNR2GPR55P2RY12KDM4EALDH1A1 | |
| SCHEMBL3621794 | 0.74 | TP53 (0.46) | CNR2GPR55KDM4EALDH1A1CNR1 | |
| SCHEMBL653429 | 0.72 | PI4KB (0.62) | CNR2GPR55P2RY12ALDH1A1 | |
| SCHEMBL794422 | 0.72 | HRH4 (0.46) | CNR2KDM4EALDH1A1CNR1HPGD | |
| SCHEMBL653760 | 0.71 | KDM4E (0.50) | CNR2GPR55KDM4EALDH1A1CNR1 |
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-2010103130-A2 | NOVEL BICYCLIC HETEROCYCLES | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) | 2010-09-16 | — | — | WO | disclosed |