Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | CASP1 | P29466 | 2/20 | 0.62 |
| ▸ | CASP7 | P55210 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL21082652 | 0.87 | BRD4 (0.64) | ESR1ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL21082653 | 0.86 | BRD4 (0.62) | ESR1ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL12639212 | 0.84 | ESR1 (0.72) | ESR1ALDH1A1RAB9AMEN1KMT2A | |
| SCHEMBL10013240 | 0.84 | ALDH1A1 (0.65) | ESR1ALDH1A1MEN1KMT2AGAA | |
| SCHEMBL4258275 | 0.82 | ESR1 (0.61) | ESR1ALDH1A1MEN1KMT2ANPSR1 | |
| SCHEMBL4258439 | 0.82 | ESR1 (0.61) | ESR1ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL9566650 | 0.81 | CASP1 (0.83) | ESR1ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL12639223 | 0.81 | ESR1 (0.72) | ESR1ALDH1A1MEN1KMT2AHTT | |
| SCHEMBL9468586 | 0.81 | ALDH1A1 (0.71) | ESR1ALDH1A1NPC1RAB9ATSHR | |
| SCHEMBL12898395 | 0.81 | ESR1 (0.59) | ESR1ALDH1A1RAB9AMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009054653-A2 | ISOINDOLONES WITH HIGH BINDING AFFINITY TO BETA-AMYLOID AGGREGATES AND FIBRILS, AND ITS USE AND PREPARATION METHOD | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2009-04-30 | — | — | WO | claimed |
| WO-2009054653-A2 | ISOINDOLONES WITH HIGH BINDING AFFINITY TO BETA-AMYLOID AGGREGATES AND FIBRILS, AND ITS USE AND PREPARATION METHOD | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2009-04-30 | — | — | WO | disclosed |