Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21142204 | 1.00 | ALDH1A1 (0.42) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL4719832 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL30399809 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL3758916 | 0.78 | MAPT (0.50) | ALDH1A1MAPTCYP3A4HSD17B10MEN1 | |
| SCHEMBL14333666 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL221671 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL5251446 | 0.77 | TDP1 (0.42) | ALDH1A1TDP1PIN1MAPTCYP3A4 | |
| SCHEMBL1100650 | 0.77 | PIN1 (0.50) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL17222837 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TDP1PIN1MAPTKDM4E | |
| SCHEMBL31104497 | 0.77 | ALDH1A1 (0.44) | ALDH1A1TDP1PIN1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-111566110-B | 1,2,3',5' -tetrahydro-2 ' H-spiro [ indole-3, 1' -pyrrolo [3,4-C ] pyrrole ] -2,3' -dione compounds as therapeutic agents for activating TP53 | 阿达梅德制药公司 | 2023-04-25 | — | — | CN | disclosed |