Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 11/20 | 0.58 |
| ▸ | FLT1 | P17948 | 2/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.58 |
| ▸ | KIT | P10721 | 1/20 | 0.58 |
| ▸ | MET | P08581 | 7/20 | 0.53 |
| ▸ | FLT4 | P35916 | 1/20 | 0.50 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | TEK | Q02763 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1258121 | 0.86 | KDR (0.55) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL1258100 | 0.86 | KDR (0.53) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL14949679 | 0.86 | KDR (0.70) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL12892680 | 0.84 | KDR (0.50) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL14949659 | 0.83 | KDR (0.58) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL1260246 | 0.83 | KDR (0.51) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL13636181 | 0.82 | KDR (0.68) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL1259926 | 0.81 | RAB9A (0.51) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL1259704 | 0.81 | KDR (0.68) | KDRFLT1AURKAPDGFRBKIT | |
| SCHEMBL1259933 | 0.81 | KDR (0.77) | KDRFLT1AURKAPDGFRBKIT |
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 |
|---|---|---|---|---|---|---|---|
| US-8445509-B2 | Fused heterocyclic derivatives and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-05-21 | — | — | US | disclosed |