Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 9/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 8/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 4/20 | 0.40 |
| ▸ | BACE1 | P56817 | 4/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.39 |
| ▸ | REN | P00797 | 1/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25026632 | 0.83 | CYP11B2 (0.57) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL3185560 | 0.79 | HCRTR1 (0.38) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL13529120 | 0.79 | CYP11B2 (0.34) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL27430518 | 0.74 | MAOA (0.58) | ALDH1A1SMN1; SMN2KDM4EMAPK1HSD17B10 | |
| SCHEMBL25028265 | 0.74 | MAOA (0.54) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL5090858 | 0.69 | MKNK1 (0.41) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL30196133 | 0.68 | KDM4E (0.70) | CYP11B2CYP11B1CYP19A1CYP17A1MKNK1 | |
| SCHEMBL11342031 | 0.68 | KDM4E (0.70) | CYP11B2CYP11B1CYP19A1CYP17A1MKNK1 | |
| SCHEMBL1881170 | 0.68 | CYP11B1 (0.65) | CYP11B2CYP11B1CYP19A1CYP17A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL11336399 | 0.67 | KDM4E (0.68) | CYP11B2CYP11B1CYP19A1CYP17A1MKNK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1833826-B1 | TRICYCLIC DELTA-OPIOID MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2009-05-27 | — | — | EP | disclosed |