Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | EP300 | Q09472 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.34 |
| ▸ | CCR4 | P51679 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | STAT1 | P42224 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24809586 | 0.86 | ERAP1 (0.45) | ERAP1ESR1ESR2NPC1EP300 | |
| SCHEMBL30099347 | 0.81 | ERAP1 (0.46) | ERAP1ESR1ESR2NPC1EP300 | |
| SCHEMBL30099332 | 0.70 | ERAP1 (0.41) | ERAP1ESR1ESR2NPC1EP300 | |
| SCHEMBL18512403 | 0.68 | NPC1 (0.50) | ERAP1NPC1KDM4EALDH1A1HPGD | |
| SCHEMBL27261015 | 0.67 | CCR4 (0.49) | ERAP1NPC1EP300CCR4MTHFD2 | |
| SCHEMBL17145056 | 0.66 | KDM4E (0.54) | NPC1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL27262406 | 0.65 | CCR4 (0.47) | ERAP1ALDH1A1CCR4KMT2AMTHFD2 | |
| SCHEMBL30708198 | 0.65 | CCR4 (0.47) | ERAP1ALDH1A1CCR4KMT2AMTHFD2 | |
| SCHEMBL18493229 | 0.64 | KDM4E (0.61) | NPC1KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL25107807 | 0.63 | HSD17B10 (0.49) | NPC1KDM4EALDH1A1MAPTSMN1; 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 |
|---|---|---|---|---|---|---|---|
| WO-2022268239-A1 | CARBOHYDRATE DERIVATIVES AND KITS FOR CELL SURFACE LABELING | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR, V. V. I. (CZ) | 2022-12-29 | — | — | WO | disclosed |