Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL577881 | 0.87 | MAPT (0.35) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP19A1 | |
| SCHEMBL13148388 | 0.83 | CYP19A1 (0.39) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP19A1 | |
| SCHEMBL13147613 | 0.82 | CYP19A1 (0.41) | SMN1; SMN2ALDH1A1KDM4EHPGDCYP19A1 | |
| SCHEMBL13148387 | 0.78 | NPC1 (0.43) | SMN1; SMN2ALDH1A1KDM4ECYP19A1MAPT | |
| SCHEMBL13147759 | 0.77 | CSF1R (0.49) | ALDH1A1KDM4ERAB9APDE2A | |
| SCHEMBL13147338 | 0.76 | PDE2A (0.37) | SMN1; SMN2ALDH1A1KDM4ECYP19A1MAPT | |
| SCHEMBL13147610 | 0.75 | PDE2A (0.40) | ALDH1A1KDM4ECYP19A1MAPTRAB9A | |
| SCHEMBL13148392 | 0.75 | BRD4 (0.40) | PDE2ALMNATSHRMAPK1 | |
| SCHEMBL13147612 | 0.75 | PDE2A (0.38) | SMN1; SMN2ALDH1A1KDM4ECYP19A1MAPT | |
| SCHEMBL13148391 | 0.75 | PDE2A (0.40) | ALDH1A1KDM4ECYP19A1MAPTRAB9A |
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-2010118078-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-10-14 | — | — | WO | disclosed |