Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 14/20 | 0.44 |
| ▸ | FLT1 | P17948 | 13/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 8/20 | 0.44 |
| ▸ | KIT | P10721 | 7/20 | 0.43 |
| ▸ | CSF1R | P07333 | 2/20 | 0.43 |
| ▸ | FLT4 | P35916 | 2/20 | 0.43 |
| ▸ | CIT | O14578 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | HLA-A | P04439 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13955571 | 0.90 | KDR (0.48) | RAB9ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL13955411 | 0.85 | KDR (0.48) | RAB9AHPGDCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13955639 | 0.82 | SMN1; SMN2 (0.52) | RAB9ANPC1ALDH1A1SMN1; SMN2KDR | |
| SCHEMBL13955486 | 0.81 | FLT1 (0.64) | RAB9ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL2201541 | 0.81 | FLT1 (0.64) | KDRFLT1PDGFRBKITCSF1R | |
| SCHEMBL3668971 | 0.81 | KDR (0.66) | ALDH1A1SMN1; SMN2TDP1KDRFLT1 | |
| SCHEMBL13955585 | 0.81 | KDR (0.55) | RAB9ANPC1HPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL13955592 | 0.81 | CYP1A2 (0.46) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL13955412 | 0.80 | KDR (0.48) | CYP1A2KDRFLT1PDGFRBKIT | |
| SCHEMBL13955485 | 0.79 | FLT1 (0.52) | RAB9ATDP1KDRFLT1PDGFRB |
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 |