Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 8/20 | 0.36 |
| ▸ | HPGDS | O60760 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 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 | |
|---|---|---|---|---|
| SCHEMBL14413596 | 0.88 | CHEK1 (0.42) | PIK3CDHPGDSJAK2JAK1TRPV3 | |
| SCHEMBL14050948 | 0.78 | CCNA2 (0.42) | PIK3CDHPGDSTRPV3KDM4EALDH1A1 | |
| SCHEMBL14050791 | 0.78 | PIK3CD (0.38) | PIK3CDHPGDSTRPV3KDM4EALDH1A1 | |
| SCHEMBL14413595 | 0.76 | CHEK1 (0.46) | HPGDSJAK2JAK1TRPV3KDM4E | |
| SCHEMBL14413601 | 0.75 | CHEK1 (0.42) | PIK3CDHPGDSJAK2JAK1TRPV3 | |
| SCHEMBL14051084 | 0.74 | CHEK1 (0.40) | PIK3CDHPGDSJAK2JAK1TRPV3 | |
| SCHEMBL14051086 | 0.73 | CHEK1 (0.50) | HPGDSPRMT5 | |
| SCHEMBL14413603 | 0.73 | CHEK1 (0.42) | PIK3CDHPGDSJAK2JAK1TRPV3 | |
| SCHEMBL14545858 | 0.73 | CHEK1 (0.46) | PIK3CDHPGDSJAK2JAK1ALOX5AP | |
| SCHEMBL11931273 | 0.73 | CHEK1 (0.59) | — |
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-1931677-B1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-04-20 | — | — | EP | disclosed |