Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 11/20 | 0.50 |
| ▸ | FLT1 | P17948 | 11/20 | 0.50 |
| ▸ | KIT | P10721 | 10/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | CIT | O14578 | 1/20 | 0.40 |
| ▸ | HLA-A | P04439 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | FRK | P42685 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13955411 | 0.87 | KDR (0.48) | KDRPDGFRBFLT1KITEGFR | |
| SCHEMBL13955412 | 0.84 | KDR (0.48) | KDRPDGFRBFLT1KITIDO1 | |
| SCHEMBL13955593 | 0.83 | FLT1 (0.43) | KDRPDGFRBFLT1KITEGFR | |
| SCHEMBL3152355 | 0.83 | FLT1 (0.64) | KDRPDGFRBFLT1KITEGFR | |
| SCHEMBL13955450 | 0.82 | FLT1 (0.48) | KDRPDGFRBFLT1KITMEN1 | |
| SCHEMBL13955587 | 0.81 | FLT1 (0.46) | KDRPDGFRBFLT1KITGRM4 | |
| SCHEMBL13955448 | 0.81 | FLT1 (0.47) | KDRPDGFRBFLT1KITEGFR | |
| SCHEMBL2203269 | 0.80 | FLT1 (0.46) | KDRPDGFRBFLT1KITMEN1 | |
| SCHEMBL13955486 | 0.78 | FLT1 (0.64) | KDRPDGFRBFLT1KITMEN1 | |
| SCHEMBL2201541 | 0.78 | FLT1 (0.64) | KDRPDGFRBFLT1KITEGFR |
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-1603566-B1 | USE OF ISOQUINOLINE DERIVATIVES FOR TREATING CANCER AND MAP KINASE RELATED DISEASES | NOVARTIS AG (CH) | 2009-01-21 | — | — | EP | disclosed |