Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 12/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 10/20 | 0.49 |
| ▸ | CDK2 | P24941 | 10/20 | 0.49 |
| ▸ | CCNA1 | P78396 | 10/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15032954 | 0.85 | CHEK1 (0.45) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15006909 | 0.85 | CHEK1 (0.45) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15006910 | 0.85 | CHEK1 (0.45) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL20332 | 0.83 | CHEK1 (0.52) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15007232 | 0.82 | DGAT1 (0.38) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15032955 | 0.82 | DGAT1 (0.38) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15007231 | 0.82 | DGAT1 (0.38) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL15026293 | 0.82 | CHEK1 (0.64) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL20761 | 0.82 | CHEK1 (0.52) | CHEK1CCNA2CDK2CCNA1MAPT | |
| SCHEMBL21964 | 0.80 | CHEK1 (0.42) | CHEK1CCNA2CDK2CCNA1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2608669-B1 | NOVEL PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS | MERCK SHARP & DOHME (US) | 2016-06-22 | — | — | EP | disclosed |