Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 5/20 | 0.51 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.51 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.46 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5452156 | 0.89 | ALDH1A1 (0.56) | CDK2CHEK1CCNA2CCNA1ALDH1A1 | |
| SCHEMBL7845119 | 0.80 | ALDH1A1 (0.48) | CDK2CHEK1CCNA2CCNA1ALDH1A1 | |
| SCHEMBL7846570 | 0.77 | ALDH1A1 (0.68) | CDK2CHEK1CCNA2CCNA1ALDH1A1 | |
| SCHEMBL7845288 | 0.77 | KDM4E (0.48) | CDK2CHEK1CCNA2CCNA1ALDH1A1 | |
| SCHEMBL7847041 | 0.74 | S100A4 (0.56) | CDK2ALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL7846516 | 0.74 | RAD52 (0.51) | CDK2CHEK1CCNA2CCNA1ALDH1A1 | |
| SCHEMBL5452103 | 0.74 | KDM4E (0.56) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL19783 | 0.73 | NPC1 (0.52) | ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A | |
| SCHEMBL17966386 | 0.72 | ALDH1A1 (0.55) | CDK2ALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL7849116 | 0.72 | ALDH1A1 (0.51) | CDK2CHEK1CCNA2CCNA1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2608669-A1 | NOVEL PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-07-03 | — | — | EP | disclosed |
| WO-2012027236-A1 | NOVEL PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES AS mTOR INHIBITORS | SCHERING CORPORATION (US) | 2012-03-01 | — | — | WO | disclosed |
| WO-2011090935-A1 | PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-28 | — | — | WO | disclosed |