Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL29957503 | 0.88 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1OPRM1OPRD1ALDH1A1 | |
| SCHEMBL15465164 | 0.82 | AR (0.45) | ALDH1A1L3MBTL1HPGDSMN1; SMN2 | |
| SCHEMBL29958288 | 0.81 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1OPRM1OPRD1ALDH1A1 | |
| SCHEMBL7218207 | 0.80 | CES2 (0.55) | HSP90AA1HSP90AB1OPRD1ALDH1A1MAPT | |
| SCHEMBL12677875 | 0.79 | HPGD (0.51) | HSP90AA1HSP90AB1OPRM1OPRD1ALDH1A1 | |
| SCHEMBL29956454 | 0.78 | CYP3A4 (0.47) | HSP90AA1HSP90AB1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL4037887 | 0.78 | CYP3A4 (0.47) | HSP90AA1HSP90AB1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL10156537 | 0.78 | ALOX5AP (0.43) | HSP90AA1HSP90AB1OPRM1OPRD1ALDH1A1 | |
| SCHEMBL29955871 | 0.77 | TRPM8 (0.36) | MLYCDRAB9A | |
| SCHEMBL4847318 | 0.76 | CES2 (0.39) | SMN1; SMN2 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |