Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.37 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.34 |
| ▸ | LIPC | P11150 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.33 |
| ▸ | CCND1 | P24385 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL29971072 | 1.00 | PDPK1 (0.41) | PDPK1LOXL2LOXL3LIPCLIPG | |
| SCHEMBL20983568 | 0.93 | LOXL2 (0.45) | PDPK1LOXL2LOXL3CCNB2CCNE2 | |
| SCHEMBL19274665 | 0.91 | PDPK1 (0.38) | PDPK1LOXL2LOXL3DYRK1AL3MBTL1 | |
| SCHEMBL29971303 | 0.89 | LOXL2 (0.45) | PDPK1LOXL2LOXL3ACACBACACA | |
| SCHEMBL28639514 | 0.84 | GSK3B (0.40) | PDPK1LOXL2LOXL3DYRK1A | |
| SCHEMBL29971031 | 0.84 | GSK3B (0.40) | PDPK1LOXL2LOXL3DYRK1A | |
| SCHEMBL22542983 | 0.83 | PDPK1 (0.40) | PDPK1CCNB2CCNE2CDK1CDK4 | |
| SCHEMBL29971469 | 0.83 | PDPK1 (0.40) | PDPK1CCNB2CCNE2CDK1CDK4 | |
| SCHEMBL29970963 | 0.83 | PDPK1 (0.41) | PDPK1LOXL2CCNB2CCNE2CDK1 | |
| SCHEMBL28644316 | 0.83 | PDPK1 (0.41) | PDPK1LOXL2CCNB2CCNE2CDK1 |
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-109311839-B | Methylamine derivatives as lysyl oxidase inhibitors for the treatment of cancer | 癌症研究协会皇家癌症医院 | 2021-11-02 | — | — | CN | disclosed |