Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 6/20 | 0.44 |
| ▸ | RPTOR | Q8N122 | 6/20 | 0.44 |
| ▸ | MLST8 | Q9BVC4 | 6/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 11/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 11/20 | 0.33 |
| ▸ | CDK2 | P24941 | 11/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 11/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | STAT1 | P42224 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAP3K12 | Q12852 | 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 | |
|---|---|---|---|---|
| SCHEMBL14245953 | 1.00 | MTOR (0.44) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL2148249 | 1.00 | MTOR (0.44) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL2148029 | 0.89 | MTOR (0.44) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL17399425 | 0.89 | MTOR (0.44) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL14246058 | 0.89 | MTOR (0.44) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL2147104 | 0.89 | MTOR (0.39) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL14245714 | 0.89 | MTOR (0.39) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL17399311 | 0.89 | MTOR (0.39) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL2147745 | 0.88 | MTOR (0.48) | MTORRPTORMLST8CHEK1CCNA2 | |
| SCHEMBL12460908 | 0.88 | MTOR (0.48) | MTORRPTORMLST8CHEK1CCNA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9227971-B2 | Pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-01-05 | — | — | US | disclosed |