Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21305574 | 0.90 | AR (0.43) | CASP1ALDH1A1ARNPSR1MEN1 | |
| SCHEMBL21305371 | 0.76 | TSHR (0.53) | ALDH1A1ARMEN1KMT2ATSHR | |
| SCHEMBL14262216 | 0.75 | CASP1 (0.43) | CASP1ARNPSR1MEN1KMT2A | |
| SCHEMBL5543216 | 0.73 | MAPT (0.49) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL30555452 | 0.73 | MAPT (0.49) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| Nitrogen SCHEMBL28056541 | 0.72 | TSHR (0.60) | ALDH1A1ARMEN1KMT2ATSHR | |
| SCHEMBL29637724 | 0.72 | TSHR (0.65) | ALDH1A1ARMEN1KMT2ATSHR | |
| SCHEMBL127000 | 0.72 | TSHR (0.65) | ALDH1A1ARMEN1KMT2ATSHR | |
| SCHEMBL5608705 | 0.71 | TSHR (0.50) | ARMEN1KMT2ATSHRNPC1 | |
| Formaldehyde SCHEMBL9868053 | 0.70 | SMN1; SMN2 (0.58) | CASP1ALDH1A1ARMEN1KMT2A |
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-2022149617-A1 | COMPOUND LIBRARY | 中外製薬株式会社 | 2022-07-14 | — | — | WO | disclosed |