Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL693789 | 0.85 | PTGS2 (0.57) | ALDH1A1HPGDPTGS2NR1H4PTGS1 | |
| SCHEMBL10760564 | 0.83 | EPHX1 (0.55) | ALDH1A1RECQLHSD17B10HPGDTP53 | |
| SCHEMBL14386006 | 0.83 | EPHX1 (0.55) | ALDH1A1RECQLHSD17B10HPGDTP53 | |
| SCHEMBL11272564 | 0.82 | HPGD (0.49) | ALDH1A1RECQLHSD17B10HPGDTP53 | |
| SCHEMBL27536587 | 0.81 | RXFP1 (0.50) | ALDH1A1RECQLHSD17B10CYP3A4THRB | |
| SCHEMBL27536643 | 0.78 | MAPT (0.43) | HPGDPTGS2SMN1; SMN2GAAMAPT | |
| SCHEMBL11586901 | 0.77 | LMNA (0.47) | HPGDPTGS2SMN1; SMN2CA12CA1 | |
| SCHEMBL27512331 | 0.77 | CYP2C9 (0.48) | ALDH1A1HPGDHIF1APTGS2SMN1; SMN2 | |
| SCHEMBL28003757 | 0.76 | LMNA (0.58) | ALDH1A1RECQLHPGDSMN1; SMN2KIF11 | |
| SCHEMBL28806262 | 0.75 | MEN1 (0.46) | MEN1RAB9AKMT2A |
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 |