Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21628043 | 0.83 | TYR (0.46) | TP53TSHRTYRFFAR2KDM4E | |
| SCHEMBL27536588 | 0.81 | TDP1 (0.46) | ALDH1A1RECQLHSD17B10CA2CA1 | |
| SCHEMBL27536646 | 0.78 | MAPT (0.43) | ALDH1A1RECQLHSD17B10TP53CYP3A4 | |
| SCHEMBL29595346 | 0.77 | TYR (0.41) | TYRKIF11 | |
| SCHEMBL874206 | 0.77 | TYR (0.58) | ALDH1A1HIF1ATYRNFKB1MAPT | |
| SCHEMBL454717 | 0.77 | TYR (0.58) | ALDH1A1HIF1ATYRNFKB1MAPT | |
| SCHEMBL15141401 | 0.76 | LMNA (0.51) | ALDH1A1CA12CA2CA1HPGD | |
| SCHEMBL30406828 | 0.76 | LMNA (0.51) | ALDH1A1CA12CA2CA1HPGD | |
| SCHEMBL28053185 | 0.76 | SMN1; SMN2 (0.53) | ALDH1A1HSD17B10CA12CA2CA1 | |
| Dimethylamine SCHEMBL27923078 | 0.76 | TRPA1 (0.42) | ALDH1A1HSD17B10CYP3A4HPGDALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1252070-A | 5,7-disubstituted 4-aminopyrido [2,3,-d] pyrimidine compounds and their use as adenosine kinase inhibitors | ABBOTT LAB (US) | 2000-05-03 | — | — | CN | disclosed |