Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 12/20 | 0.47 |
| ▸ | CNR1 | P21554 | 5/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.39 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL13565699 | 1.00 | CNR2 (0.47) | CNR2CNR1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17090106 | 0.84 | DRD2 (0.44) | CNR2TSHR | |
| SCHEMBL11935242 | 0.84 | DRD2 (0.44) | CNR2TSHR | |
| SCHEMBL13565921 | 0.83 | NPY5R (0.43) | CNR2CNR1CYP3A4 | |
| SCHEMBL17090235 | 0.83 | NPY5R (0.43) | CNR2CNR1CYP3A4 | |
| SCHEMBL13565547 | 0.83 | NPC1 (0.45) | CNR2CNR1CRHR1RAB9A | |
| SCHEMBL17090165 | 0.83 | NPC1 (0.45) | CNR2CNR1CRHR1RAB9A | |
| SCHEMBL11935248 | 0.81 | CRHR1 (0.50) | CNR2CNR1CRHR1 | |
| SCHEMBL13438930 | 0.81 | CRHR1 (0.50) | CNR2CNR1CRHR1 | |
| SCHEMBL13565625 | 0.80 | NPY5R (0.41) | CNR2CRHR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |