Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.50 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11930826 | 0.88 | CHEK1 (0.53) | CDK2CHEK1CCNA2CCNA1HRH4 | |
| SCHEMBL11930813 | 0.87 | CDK2 (0.51) | CDK2CHEK1CCNA2CCNA1CYP1A2 | |
| SCHEMBL11930825 | 0.86 | CDK2 (0.47) | CDK2CHEK1CCNA2CCNA1CYP1A2 | |
| SCHEMBL11930827 | 0.82 | CDK2 (0.48) | CDK2CHEK1CCNA2CCNA1KMT2A | |
| SCHEMBL11930818 | 0.81 | HRH4 (0.49) | CDK2CHEK1CCNA2CCNA1SMPD3 | |
| SCHEMBL11930824 | 0.81 | HRH4 (0.49) | CDK2CHEK1CCNA2CCNA1SMPD3 | |
| SCHEMBL14051003 | 0.79 | CKS1B (0.49) | CDK2KMT2ASMPD3TYK2 | |
| SCHEMBL14545799 | 0.78 | CHEK1 (0.51) | CDK2CHEK1CCNA2CCNA1SMN1; SMN2 | |
| SCHEMBL14543100 | 0.77 | HRH4 (0.53) | HRH4 | |
| SCHEMBL15146127 | 0.77 | HRH4 (0.53) | HRH4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009061781-A1 | NOVEL MODULATORS OF CELL CYCLE CHECKPOINTS AND THEIR USE IN COMBINATION WITH CHECKPOINT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2009-05-14 | — | — | WO | disclosed |
| WO-2008130569-A1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |