Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 8/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 8/20 | 0.37 |
| ▸ | CDK2 | P24941 | 8/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 8/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13901469 | 0.75 | CHEK1 (0.69) | CHEK1CCNA2CDK2CCNA1KDM4E | |
| SCHEMBL13901482 | 0.71 | ADORA2A (0.46) | CHEK1CCNA2CDK2CCNA1KDM4E | |
| SCHEMBL16104567 | 0.70 | CHEK1 (0.44) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL10328065 | 0.70 | CHEK1 (0.44) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL30579310 | 0.69 | SMPD3 (0.35) | CHEK1CCNA2CDK2CCNA1KDM4E | |
| SCHEMBL11930831 | 0.69 | HRH4 (0.49) | TYK2 | |
| SCHEMBL16104605 | 0.68 | CHEK1 (0.40) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14316241 | 0.65 | CDK2 (0.46) | CHEK1CCNA2CDK2CCNA1KDM4E | |
| SCHEMBL29962126 | 0.61 | PIM1 (0.49) | CYP1A2CYP3A4TYK2 | |
| SCHEMBL23242923 | 0.61 | MEN1 (0.42) | CHEK1CCNA2CDK2CCNA1KDM4E |
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-2012047569-A1 | FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN | SCHERING CORPORATION (US) | 2012-04-12 | — | — | WO | disclosed |