Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | ITK | Q08881 | 3/20 | 0.51 |
| ▸ | AXL | P30530 | 1/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.47 |
| ▸ | CDK9 | P50750 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | FLT3 | P36888 | 4/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28691325 | 0.81 | KDM4E (0.51) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL28704770 | 0.80 | ATP4A (0.46) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL3356795 | 0.79 | KDM4E (0.41) | KDM4ENPC1RAB9AKMT2ACA2 | |
| SCHEMBL28684481 | 0.79 | CYP19A1 (0.49) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL7640854 | 0.77 | GSK3B (0.68) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL13934821 | 0.76 | NPC1 (0.55) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL31105763 | 0.75 | EIF2AK2 (0.68) | KDM4EMEN1MAPTKMT2APOLB | |
| SCHEMBL5437400 | 0.75 | KDM4E (0.58) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL6118296 | 0.74 | KDM4E (0.54) | KDM4EMEN1NPC1MAPTRAB9A | |
| SCHEMBL28696932 | 0.74 | MAP3K14 (0.73) | KDM4EMEN1MAPTKMT2ACCNA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113956240-B | Pyrimidine derivatives and application thereof in preparing antitumor drugs | 陕西师范大学 | 2023-02-14 | — | — | CN | disclosed |
| CN-113956240-A | Pyrimidine derivatives and application thereof in preparing antitumor drugs | 陕西师范大学 | 2022-01-21 | — | — | CN | disclosed |