Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL29216392 | 1.00 | NOTUM (0.53) | NOTUMALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL21055089 | 0.84 | TSHR (0.40) | NOTUMALDH1A1HPGDHSD17B10KMT2A | |
| SCHEMBL29216394 | 0.81 | OXER1 (0.43) | NOTUMALDH1A1KDM4EHSD17B10MEN1 | |
| SCHEMBL30872017 | 0.81 | OXER1 (0.43) | NOTUMALDH1A1KDM4EHSD17B10MEN1 | |
| SCHEMBL10836512 | 0.79 | NOTUM (0.56) | NOTUMALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL21055656 | 0.78 | ACLY (0.47) | NOTUML3MBTL1PIK3CA | |
| SCHEMBL30826403 | 0.76 | NOTUM (0.50) | NOTUMALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL29187805 | 0.76 | NOTUM (0.50) | NOTUMALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL13139572 | 0.75 | KMT2A (0.39) | NOTUMALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL30847966 | 0.71 | PRKCI (0.39) | ALDH1A1HPGDHSD17B10TSHRCYP3A4 |
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-117794914-A | Pyrimidine-2, 4-diamine derivatives, process for preparing the same, and pharmaceutical composition for preventing or treating cancer comprising the same as active ingredient | 韩国化学研究院 | 2024-03-29 | — | — | CN | disclosed |