Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.69 |
| ▸ | TRPV1 | Q8NER1 | 11/20 | 0.57 |
| ▸ | KDR | P35968 | 6/20 | 0.57 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.53 |
| ▸ | TEK | Q02763 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | CSF1R | P07333 | 1/20 | 0.52 |
| ▸ | RET | P07949 | 1/20 | 0.52 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.52 |
| ▸ | FLT1 | P17948 | 1/20 | 0.52 |
| ▸ | FLT4 | P35916 | 1/20 | 0.52 |
| ▸ | FLT3 | P36888 | 1/20 | 0.52 |
| ▸ | FRK | P42685 | 1/20 | 0.52 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.52 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.52 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.52 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.52 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13459944 | 0.81 | CSF1R (0.55) | RIPK1TRPV1KDRCSF1RRET | |
| SCHEMBL13459579 | 0.80 | RIPK1 (0.79) | RIPK1TRPV1KDRPDGFRB | |
| SCHEMBL13459817 | 0.80 | TRPV1 (0.53) | RIPK1TRPV1KDRCSF1RFLT1 | |
| SCHEMBL13459835 | 0.80 | RIPK1 (0.75) | RIPK1TRPV1KDREPHB4TEK | |
| SCHEMBL12776280 | 0.79 | RIPK1 (0.55) | RIPK1TRPV1KDREPHB4TEK | |
| SCHEMBL13459818 | 0.79 | RET (0.64) | RIPK1KDRTEKCSF1RRET | |
| SCHEMBL1790432 | 0.79 | TRPV1 (0.59) | RIPK1TRPV1KDRFLT3AURKB | |
| SCHEMBL16872810 | 0.79 | RAF1 (0.60) | TRPV1KDRFLT1 | |
| SCHEMBL4516431 | 0.78 | RIPK1 (0.70) | RIPK1TRPV1KDREPHB4TEK | |
| SCHEMBL9190713 | 0.77 | KDR (0.72) | TRPV1KDRBLM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010032986-A2 | NOVEL 5-(4-AMINOPHENYL)-ISOQUINOLINE DERIVATIVE, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME, AND COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PROPHYLAXIS AND TREATMENT OF MEDICAL CONDITION INDUCED BY RAF KINASE HYPERACTIVITY | 주식회사 이큐스팜 (KR) | 2010-03-25 | — | — | WO | disclosed |