Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14754451 | 0.77 | MAPT (0.50) | MEN1KMT2AMAPTSMN1; SMN2NPC1 | |
| SCHEMBL19626556 | 0.75 | ALDH1A1 (0.66) | NQO1MEN1KMT2ATP53MAPT | |
| SCHEMBL14304002 | 0.74 | PTGS2 (0.40) | RAB9AALDH1A1 | |
| SCHEMBL10280239 | 0.74 | FFAR4 (0.40) | KDM4ENPC1RAB9AGRM5GRM1 | |
| SCHEMBL17626024 | 0.73 | MEN1 (0.47) | NQO1MEN1KMT2ATP53MAPT | |
| SCHEMBL18417193 | 0.72 | NQO1 (0.82) | NQO1MEN1KMT2ATP53SMN1; SMN2 | |
| SCHEMBL5833291 | 0.72 | NQO1 (0.82) | NQO1MEN1KMT2ATP53SMN1; SMN2 | |
| SCHEMBL9155582 | 0.72 | NQO1 (0.82) | NQO1MEN1KMT2ATP53SMN1; SMN2 | |
| SCHEMBL27939699 | 0.71 | NQO1 (0.52) | NQO1MEN1KMT2ATP53MAPT | |
| SCHEMBL19625305 | 0.70 | MEN1 (0.47) | NQO1MEN1KMT2ATP53MAPT |
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-109776537-A | Purinedione as WNT pathway modulators | 新加坡科技研究局 | 2019-05-21 | — | — | CN | disclosed |