Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 9/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 6/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3175351 | 0.91 | OPRM1 (0.37) | DRD2OPRM1OPRK1KCNH2CYP2D6 | |
| SCHEMBL3173509 | 0.86 | CYP11B2 (0.38) | CYP11B2CLK4ABCB1ABCC1ABCG2 | |
| SCHEMBL13394881 | 0.86 | CYP11B2 (0.38) | CYP11B2CLK4ABCB1ABCC1ABCG2 | |
| SCHEMBL13394866 | 0.85 | DRD2 (0.38) | CYP11B2DRD2CYP11B1OPRM1OPRK1 | |
| SCHEMBL3176047 | 0.85 | DRD2 (0.38) | CYP11B2DRD2CYP11B1OPRM1OPRK1 | |
| SCHEMBL3182330 | 0.84 | DRD2 (0.36) | CYP11B2DRD2CYP11B1OPRM1OPRK1 | |
| SCHEMBL3178366 | 0.83 | OPRD1 (0.38) | CYP11B2DRD2CYP11B1CYP1A2CYP3A4 | |
| SCHEMBL3178346 | 0.80 | DRD2 (0.37) | CYP11B2DRD2CYP11B1CYP1A2SMN1; SMN2 | |
| SCHEMBL3167913 | 0.78 | CYP11B2 (0.41) | CYP11B2DRD2CYP11B1CYP1A2SMN1; SMN2 | |
| SCHEMBL3174545 | 0.76 | OPRM1 (0.37) | DRD2OPRM1OPRK1KCNH2CYP2D6 |
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-1833826-A2 | TRICYCLIC DELTA-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006069276-A2 | TRICYCLIC ō-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-06-29 | — | — | WO | disclosed |