Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 5/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
| ▸ | CDK2 | P24941 | 4/20 | 0.53 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.53 |
| ▸ | PLK1 | P53350 | 3/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 1/20 | 0.49 |
| ▸ | IGF1R | P08069 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17560321 | 0.90 | KDR (0.64) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7232833 | 0.86 | KDR (0.55) | KDRFYNCDK2CCNA2IKBKB | |
| SCHEMBL6999967 | 0.84 | KDR (0.65) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7230996 | 0.83 | FYN (0.68) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7241504 | 0.82 | FYN (0.58) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7238444 | 0.82 | FYN (0.58) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL6996576 | 0.82 | IGF1R (0.55) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7001192 | 0.80 | SYK (0.54) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL7241524 | 0.79 | CDK2 (0.59) | KDRFYNCDK2CCNA2CDK5 | |
| SCHEMBL6994864 | 0.79 | KDR (0.63) | KDRFYNCDK2CCNA2CDK5 |
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-6599908-B1 | Potent and selective inhibitors of the protein tyrosine kinases p56lck and p59fyn | CELLTECH R & D LIMITED (GB) | 2003-07-29 | — | — | US | disclosed |
| US-6057329-A | Fused polycyclic 2-aminopyrimidine derivatives | CELLTECH THERAPEUTICS LIMITED (GB) | 2000-05-02 | — | — | US | disclosed |