Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 7/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2926433 | 0.84 | MGLL (0.38) | MGLLPIK3CDHCRTR1HCRTR2RORC | |
| SCHEMBL2926435 | 0.83 | MGLL (0.37) | MGLLPIK3CDHCRTR1HCRTR2TP53 | |
| SCHEMBL8207645 | 0.76 | ALDH1A1 (0.35) | HCRTR1HCRTR2HTTTP53POLB | |
| SCHEMBL8212395 | 0.76 | ALDH1A1 (0.38) | HCRTR1HCRTR2HTTPOLBALDH1A1 | |
| SCHEMBL13176494 | 0.75 | HCRTR1 (0.39) | MGLLPIK3CDHCRTR1HCRTR2 | |
| SCHEMBL13538941 | 0.71 | HTR4 (0.45) | HCRTR1HCRTR2 | |
| SCHEMBL8849 | 0.68 | HTT (0.63) | MGLLHTTPOLBALDH1A1HPGD | |
| SCHEMBL3415793 | 0.68 | HCRTR1 (0.47) | HCRTR1HCRTR2 | |
| SCHEMBL3459632 | 0.68 | FABP4 (0.40) | PIK3CDHCRTR1HCRTR2HTTTP53 | |
| SCHEMBL2924242 | 0.68 | FABP4 (0.42) | PIK3CDHCRTR1HCRTR2POLBALDH1A1 |
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-2008038251-A2 | 3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-04-03 | — | — | WO | disclosed |