Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28374941 | 0.86 | CYP1A2 (0.36) | MEN1KMT2ATNKS2KDM4EALDH1A1 | |
| SCHEMBL28375082 | 0.86 | MEN1 (0.45) | MEN1KMT2ATNKS2KDM4EALDH1A1 | |
| SCHEMBL28374937 | 0.86 | MEN1 (0.45) | MEN1KMT2ANPC1TNKS2KDM4E | |
| SCHEMBL28886083 | 0.83 | KMT2A (0.50) | MEN1KMT2ANPC1TNKS2KDM4E | |
| SCHEMBL28370675 | 0.83 | ALDH1A1 (0.50) | MEN1KMT2ANPC1TNKS2KDM4E | |
| SCHEMBL30674462 | 0.74 | MEN1 (0.47) | MEN1KMT2ANPC1TNKS2MAPT | |
| SCHEMBL6082762 | 0.74 | MEN1 (0.47) | MEN1KMT2ANPC1TNKS2MAPT | |
| SCHEMBL28374936 | 0.72 | DRD2 (0.35) | NOS2DRD2DRD1 | |
| SCHEMBL937802 | 0.69 | SMN1; SMN2 (0.35) | MEN1KMT2ATNKS2KDM4EALDH1A1 | |
| SCHEMBL2044013 | 0.68 | — | — |
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-110872291-B | Tetrahydropyridopyrimidine compound and preparation method and application thereof | 五邑大学 | 2021-06-25 | — | — | CN | disclosed |
| CN-110872291-A | Tetrahydropyridopyrimidine compound and preparation method and application thereof | 五邑大学 | 2020-03-10 | — | — | CN | disclosed |