Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30257936 | 0.69 | ALDH1A1 (0.37) | MEN1ALDH1A1KMT2A | |
| SCHEMBL23497804 | 0.68 | ALDH1A1 (0.33) | MEN1ALDH1A1KMT2A | |
| SCHEMBL29932206 | 0.68 | ALDH1A1 (0.33) | MEN1ALDH1A1KMT2A | |
| SCHEMBL13330404 | 0.65 | OPRM1 (0.39) | — | |
| SCHEMBL30829193 | 0.61 | SLC6A4 (0.41) | MEN1KMT2A | |
| SCHEMBL6441060 | 0.60 | HDAC4 (0.36) | MEN1ALDH1A1KMT2A | |
| SCHEMBL28120389 | 0.59 | SIGMAR1 (0.38) | — | |
| Water SCHEMBL28199644 | 0.58 | SIGMAR1 (0.37) | — | |
| SCHEMBL30228535 | 0.57 | FFAR1 (0.41) | MEN1ALDH1A1KMT2A | |
| SCHEMBL8416690 | 0.57 | OPRM1 (0.43) | — |
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-2021116686-A1 | METHYL 2-ALLYL-1 -METHYL-3-OXOINDOLINE-2-CARBOXYLATE AND 9A-ALLYL-1,2,3,9A-TETRAHYDRO-9H-PYRROLO[1,2-A]INDOL-9-ONE DERIVATIVES AND RELATED COMPOUNDS FOR USE AS FLUORESCENT MARKERS FOR LABELLING OF DRUGS, AMINO ACIDS AN PROTEINS | UNIVERSITY OF LANCASTER (GB) | 2021-06-17 | — | — | WO | disclosed |