Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.51 |
| ▸ | CDK1 | P06493 | 12/20 | 0.51 |
| ▸ | CDK2 | P24941 | 12/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CDK4 | P11802 | 2/20 | 0.51 |
| ▸ | CDK7 | P50613 | 2/20 | 0.51 |
| ▸ | CDK9 | P50750 | 2/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.51 |
| ▸ | CCND1 | P24385 | 1/20 | 0.51 |
| ▸ | CCNH | P51946 | 1/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.50 |
| ▸ | ULK1 | O75385 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4060935 | 0.86 | CDK1 (0.64) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367809 | 0.86 | CDK1 (0.52) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4062129 | 0.86 | KDR (0.54) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367782 | 0.85 | CDK2 (0.53) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL4064167 | 0.85 | KDR (0.53) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367784 | 0.83 | KDR (0.53) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367797 | 0.83 | KDR (0.49) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367790 | 0.83 | CDK1 (0.54) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367781 | 0.83 | CDK1 (0.52) | KDRCDK1CDK2CA2CDK4 | |
| SCHEMBL14367789 | 0.83 | CDK2 (0.52) | KDRCDK1CDK2CA2CDK4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7288547-B2 | CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents | SCHERING AG (DE) | 2007-10-30 | — | — | US | disclosed |
| US-7288547-B2 | CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents | SCHERING AG (DE) | 2007-10-30 | — | — | US | disclosed |