Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 11/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27824953 | 0.84 | HPGD (0.47) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL29824703 | 0.82 | MAPK13 (0.51) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL22955599 | 0.82 | MAPK13 (0.51) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL29824605 | 0.82 | NPC1 (0.49) | PTGESNPC1ALDH1A1RAB9AHPGD | |
| SCHEMBL22955874 | 0.82 | ALDH1A1 (0.52) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL2951537 | 0.82 | NPC1 (0.49) | PTGESNPC1ALDH1A1RAB9AHPGD | |
| SCHEMBL27843942 | 0.81 | HPGD (0.51) | PDPK1NPC1ALDH1A1RAB9AHPGD | |
| SCHEMBL784353 | 0.81 | NPC1 (0.66) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL29825055 | 0.81 | NPC1 (0.66) | NPC1ALDH1A1RAB9AHPGDKDM4E | |
| SCHEMBL31677102 | 0.81 | NPC1 (0.66) | NPC1ALDH1A1RAB9AHPGDKDM4E |
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-2021022061-A1 | ARYL HYDROCARBON RECEPTOR ACTIVATORS | OREGON STATE UNIVERSITY (US) | 2021-02-04 | — | — | WO | disclosed |