Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | CCR4 | P51679 | 1/20 | 0.38 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23174835 | 0.85 | KDM4E (0.42) | CYP1A2CYP3A4CYP2D6KDM4ECNR1 | |
| SCHEMBL3437213 | 0.80 | ELANE (0.46) | CYP1A2CYP3A4CYP2D6KDM4ESLC16A3 | |
| SCHEMBL14892448 | 0.77 | KDM4E (0.41) | KDM4ECNR1CNR2SLC16A3FEN1 | |
| SCHEMBL13330186 | 0.75 | ELANE (0.42) | CYP1A2CYP3A4CYP2D6KDM4ESLC16A3 | |
| SCHEMBL20548896 | 0.75 | KDM4E (0.44) | CYP1A2KDM4ECNR1CNR2CCR4 | |
| SCHEMBL8414862 | 0.75 | CNR1 (0.48) | KDM4ECNR1CNR2SMN1; SMN2 | |
| SCHEMBL1273316 | 0.75 | CCR4 (0.39) | KDM4ECNR1CNR2CCR4FEN1 | |
| SCHEMBL17910321 | 0.73 | KDM4E (0.41) | CYP1A2KDM4ECNR1CNR2FEN1 | |
| SCHEMBL5009531 | 0.73 | L3MBTL1 (0.45) | CYP1A2KDM4ECNR1CNR2FEN1 | |
| SCHEMBL29585194 | 0.73 | KDM4E (0.41) | CYP1A2KDM4ECNR1CNR2FEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011138657-A1 | ARYL SUBSTITUTED OLEFINIC COMPOUNDS AS PDE10A INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-11-10 | — | — | WO | disclosed |
| WO-2011012622-A1 | BENZOXAZINONE DERIVATIVES FOR THE TREATMENT OF GLYTL MEDIATED DISORDERS | GLAXO GROUP LIMITED (GB) | 2011-02-03 | — | — | WO | disclosed |