Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 3/20 | 0.41 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.34 |
| ▸ | SLC34A1 | Q06495 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19967295 | 0.77 | KMT2A (0.34) | CRHR1KDM4EHPGDPGRNR3C2 | |
| SCHEMBL12871872 | 0.70 | CRHR1 (0.46) | PDE2ACRHR1ALDH1A1NR1H2NR1H3 | |
| SCHEMBL1025606 | 0.69 | GRM5 (0.38) | PDE2ACRHR1MAPTNR1H2NR1H3 | |
| SCHEMBL5254957 | 0.68 | PDE2A (0.49) | PDE2ACRHR1ALDH1A1KDM4EHPGD | |
| SCHEMBL14996603 | 0.67 | CNR1 (0.48) | PDE2ACRHR1ALDH1A1KDM4EHPGD | |
| SCHEMBL27519517 | 0.65 | PDE2A (0.46) | PDE2AALDH1A1KDM4EMAPTNR1H2 | |
| SCHEMBL1023884 | 0.65 | CYP1A2 (0.38) | PDE2ACRHR1KDM4EMAPTBACE1 | |
| SCHEMBL14010474 | 0.65 | RAB9A (0.36) | ALDH1A1MAPTHTTMEN1KMT2A | |
| SCHEMBL3489183 | 0.64 | SMN1; SMN2 (0.48) | PDE2ACRHR1ALDH1A1KDM4EHPGD | |
| SCHEMBL19953206 | 0.63 | POLB (0.38) | MAPTHTTBACE1MEN1KMT2A |
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-2018048969-A1 | MULTI-TARGETED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2018-03-15 | — | — | WO | disclosed |