Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 5/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | DRD3 | P35462 | 3/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL5120558 | 0.83 | MAPT (0.41) | HRH3CYP2D6CYP1A2CYP3A4TSHR | |
| SCHEMBL5500227 | 0.82 | PARP1 (0.41) | HRH3CYP2D6CYP1A2CYP3A4TSHR | |
| SCHEMBL5504494 | 0.81 | HRH3 (0.43) | HRH3CYP2D6TSHRCYP2C19SIGMAR1 | |
| SCHEMBL5499787 | 0.69 | OPRM1 (0.41) | TSHRICMTDRD2DRD3SIGMAR1 | |
| SCHEMBL5125147 | 0.69 | CHRM3 (0.43) | TP53MAPTLMNACHRM3 | |
| SCHEMBL5118380 | 0.68 | PARP1 (0.39) | HRH3CYP2D6TSHRCYP2C19SIGMAR1 | |
| SCHEMBL3185223 | 0.67 | DRD2 (0.35) | HRH3CYP2D6DRD2MEN1KMT2A | |
| Acetamide SCHEMBL27709114 | 0.66 | GFER (0.43) | HRH3CYP2D6CYP1A2CYP3A4DRD2 | |
| SCHEMBL3173593 | 0.66 | LMNA (0.39) | CYP3A4CYP2C19TP53MAPTLMNA | |
| SCHEMBL5113922 | 0.65 | MAPT (0.43) | TP53MAPTLMNACHRM2CHRM1 |
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-1846400-A2 | TRICYCLIC DELTA-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006074388-A2 | TRICYCLIC δ-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-07-13 | — | — | WO | disclosed |