Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 5/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.41 |
| ▸ | PAK4 | O96013 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | BRD2 | P25440 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6982836 | 1.00 | JAK3 (0.44) | JAK3KDRLRRK2PAK4TSHR | |
| SCHEMBL6983833 | 0.93 | JAK3 (0.47) | JAK3KDRPAK4RXFP1FLT3 | |
| SCHEMBL6983839 | 0.93 | JAK3 (0.47) | JAK3KDRPAK4RXFP1FLT3 | |
| SCHEMBL8192969 | 0.92 | HTT (0.45) | JAK3KDRLRRK2PAK4CYP19A1 | |
| SCHEMBL7984576 | 0.88 | KDR (0.45) | JAK3KDRLRRK2PAK4CA12 | |
| SCHEMBL7987912 | 0.88 | TLR8 (0.40) | KDRLRRK2PAK4CA12CA1 | |
| SCHEMBL6980882 | 0.88 | TLR8 (0.40) | KDRLRRK2PAK4CA12CA1 | |
| SCHEMBL7225500 | 0.87 | LRRK2 (0.46) | JAK3KDRLRRK2TSHRCA12 | |
| SCHEMBL7225498 | 0.87 | LRRK2 (0.46) | JAK3KDRLRRK2TSHRCA12 | |
| SCHEMBL6984569 | 0.87 | JAK3 (0.42) | JAK3PAK4RXFP1KMT2APDPK1 |
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-6169106-B1 | ANTITUMOUR AGENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-01-02 | — | — | US | disclosed |