Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | HPGDS | O60760 | 2/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 7/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28609714 | 0.88 | GRM5 (0.45) | GRM5LTA4HMAPK14CYP19A1CYP11B1 | |
| SCHEMBL30835058 | 0.88 | GRM5 (0.45) | GRM5LTA4HMAPK14CYP19A1CYP11B1 | |
| SCHEMBL30835094 | 0.86 | CYP11B1 (0.54) | GRM5CYP19A1CYP11B1CYP11B2PTGER1 | |
| SCHEMBL28286344 | 0.86 | CYP11B1 (0.54) | GRM5CYP19A1CYP11B1CYP11B2PTGER1 | |
| SCHEMBL30835107 | 0.81 | GRM5 (0.47) | GRM5PTGER1CYP3A4CYP2C9MCL1 | |
| SCHEMBL28600767 | 0.80 | GRM5 (0.47) | GRM5PTGER1CYP3A4CYP2C9 | |
| SCHEMBL30835106 | 0.80 | GRM5 (0.47) | GRM5PTGER1CYP3A4CYP2C9 | |
| SCHEMBL19830901 | 0.80 | NPC1 (0.41) | GRM5LTA4HMAPK14CYP19A1CYP11B1 | |
| SCHEMBL30834996 | 0.80 | NPC1 (0.41) | GRM5LTA4HMAPK14CYP19A1CYP11B1 | |
| SCHEMBL29228081 | 0.79 | GRM5 (0.39) | GRM5CYP19A1CYP11B1CYP11B2CYP3A4 |
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-2018021406-A1 | METAL COMPLEX AND ELECTRON-TRANSPORTING MATERIAL USING SAME | 大電株式会社 | 2018-02-01 | — | — | WO | disclosed |