Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.50 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22625286 | 0.84 | LCK (0.66) | LCKKMT2AMAPTUSP2PKM | |
| SCHEMBL28405872 | 0.82 | ALDH1A1 (0.53) | LCKKMT2AMAPTUSP2PKM | |
| SCHEMBL30381597 | 0.79 | PARP1 (0.62) | LCKKMT2AMAPTUSP2PKM | |
| SCHEMBL7147011 | 0.79 | PARP1 (0.62) | LCKKMT2AMAPTUSP2PKM | |
| SCHEMBL677432 | 0.78 | MAPT (0.62) | LCKKMT2AMAPTUSP2PKM | |
| SCHEMBL8483910 | 0.78 | KDR (0.71) | CYP1A2ITGA4ITGB7KMT2AMAPT | |
| SCHEMBL8483914 | 0.78 | KDR (0.71) | CYP1A2ITGA4ITGB7KMT2AMAPT | |
| SCHEMBL4157456 | 0.77 | CYP19A1 (0.46) | CYP1A2ITGA4ITGB7MAPTPIM1 | |
| SCHEMBL8072577 | 0.77 | MAOA (0.49) | LCKCYP1A2ITGA4ITGB7MAPT | |
| SCHEMBL3372898 | 0.76 | LCK (0.56) | LCKKMT2AMAPTUSP2PKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110028407-B | Method for preparing spiro [ cyclopropane-1, 2 ' -indene ] -1 ', 3 ' -diketone compound | 苏州大学 | 2021-08-27 | — | — | CN | disclosed |
| WO-2020223439-A1 | AURONES AND METHODS OF USING AURONES TO TREAT TUBERCULOSIS | Middle Tennessee State University (US) | 2020-11-05 | — | — | WO | disclosed |
| WO-2018114965-A1 | CLPX INHIBITORY COMPOUNDS FOR THE TREATMENT OF MULTI RESISTANT STAPHYLOCOCCUS AUREUS VIRULENCE AND FOR THE TREATMENT OF LEUKEMIA | Technische Universität München (DE) | 2018-06-28 | — | — | WO | disclosed |