Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 3/20 | 0.46 |
| ▸ | CDK1 | P06493 | 2/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | KRAS | P01116 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL802084 | 0.81 | CDK1 (0.54) | TSPOCDK1CCNB2CCNB1GSK3B | |
| SCHEMBL29357718 | 0.81 | CDK1 (0.54) | TSPOCDK1CCNB2CCNB1GSK3B | |
| SCHEMBL2788024 | 0.80 | CDK1 (0.40) | TSPOCDK1CCNB2CCNB1GSK3B | |
| SCHEMBL5025287 | 0.75 | MEN1 (0.62) | MEN1RAD52KMT2AKDM4ELMNA | |
| SCHEMBL5025317 | 0.75 | MEN1 (0.62) | MEN1RAD52KMT2AKDM4ELMNA | |
| SCHEMBL5022677 | 0.75 | MEN1 (0.62) | MEN1RAD52KMT2AKDM4ELMNA | |
| SCHEMBL15456145 | 0.73 | CDK1 (0.49) | TSPOCDK1CCNB2CCNB1GSK3B | |
| SCHEMBL409607 | 0.73 | CDK1 (0.54) | CDK1CCNB2CCNB1GSK3BCCNB3 | |
| SCHEMBL15798202 | 0.72 | CNR2 (0.67) | TSPOPPARGPPARACNR2CAMK2D | |
| SCHEMBL18674484 | 0.72 | TSPO (0.68) | TSPOKRAS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010136109-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2010-12-02 | — | — | WO | disclosed |