Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6299167 | 0.87 | GAA (0.52) | ALDH1A1HPGDHTTGAAPLK1 | |
| SCHEMBL3561822 | 0.77 | CYP1A2 (0.52) | ALDH1A1HPGDHTTKDM4EMEN1 | |
| SCHEMBL30800895 | 0.77 | CYP1A2 (0.52) | ALDH1A1HPGDHTTKDM4EMEN1 | |
| SCHEMBL11852024 | 0.76 | APOBEC3G (0.62) | ALDH1A1HPGDAPOBEC3GRAB9ANPC1 | |
| SCHEMBL6294348 | 0.75 | ALDH1A1 (0.53) | ALDH1A1HPGDHTTSMN1; SMN2MPO | |
| SCHEMBL3540980 | 0.75 | KDM4E (0.60) | ALDH1A1MPOKDM4E | |
| SCHEMBL17383212 | 0.73 | RXFP1 (0.56) | ALDH1A1HPGDHTTGAAAPOBEC3G | |
| SCHEMBL22701071 | 0.72 | CNR2 (0.49) | ALDH1A1HPGDGAARAB9ANPC1 | |
| SCHEMBL6232859 | 0.72 | ALDH1A1 (0.43) | ALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL9280731 | 0.69 | KDM4E (0.45) | ALDH1A1HPGDHTTSMN1; SMN2DAO |
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 |
|---|---|---|---|---|---|---|---|
| US-6872727-B1 | Polycyclic pyrimidine -2,4(1H,3H)-diones with functionalized alkyl residues at the 1- and/or 3-position(s); methods for their synthesis and pharmaceutical preparation | PRIVATES INSTITUT FUR BIOMEDIZINISCHE FORSCHUNG UND BERATUNG (DE) | 2005-03-29 | — | — | US | disclosed |