Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7702569 | 0.67 | XDH (0.33) | ALDH1A1XDH | |
| SCHEMBL21431108 | 0.64 | XDH (0.34) | ALDH1A1XDH | |
| SCHEMBL21434271 | 0.63 | GSK3A (0.36) | ALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL25410369 | 0.63 | CHEK1 (0.37) | ALDH1A1KDM4EXDH | |
| SCHEMBL31687853 | 0.62 | CHEK1 (0.32) | — | |
| SCHEMBL7700737 | 0.62 | PDE3B (0.39) | XDH | |
| SCHEMBL7701725 | 0.60 | MAPK8 (0.33) | ALDH1A1XDH | |
| SCHEMBL11304872 | 0.60 | PDE1A (0.46) | ALDH1A1KDM4ENPC1RAB9AXDH | |
| SCHEMBL11080771 | 0.60 | PDE10A (0.43) | KDM4EKDM5BXDH | |
| SCHEMBL31136644 | 0.60 | GABRA5 (0.44) | ALDH1A1KDM4EKDM5BGABRA1GABRA5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002081473-A1 | SUBSTITUTED AZOLOAZIN(THI)ONES | BAYER CROPSCIENCE AG (DE) | 2002-10-17 | — | — | WO | disclosed |
| US-RE30511-E | ENZYME INHIBITOR, HERBICIDE, CYCLIZATION | AMERICAN CYANAMID COMPANY (US) | 1981-02-10 | — | — | US | disclosed |
| US-4168964-A | HERBICIDES | AMERICAN CYANAMID COMPANY (US) | 1979-09-25 | — | — | US | disclosed |
| US-4124766-A | INTERMEDIATES FOR PHOSPHODIESTERASE INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 1978-11-07 | — | — | US | disclosed |
| US-4107307-A | ENZYME INHIBITORS, HERBICIDES, RING CLOSURE | AMERICAN CYANAMID COMPANY (US) | 1978-08-15 | — | — | US | disclosed |