Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7987801 | 0.92 | PDPK1 (0.48) | RAB9ANPC1MAPTPDPK1AURKA | |
| SCHEMBL2123765 | 0.92 | RAB9A (0.49) | RAB9ANPC1MAPTNPSR1PSEN1 | |
| SCHEMBL2123767 | 0.92 | RAB9A (0.49) | RAB9ANPC1MAPTNPSR1PSEN1 | |
| SCHEMBL7984576 | 0.89 | KDR (0.45) | RAB9ANPC1PDPK1NPSR1KDR | |
| SCHEMBL6980872 | 0.88 | PAK4 (0.43) | RAB9ANPC1MAPTNPSR1KDR | |
| SCHEMBL7982075 | 0.88 | PAK4 (0.43) | RAB9ANPC1MAPTNPSR1KDR | |
| SCHEMBL7224171 | 0.87 | MAPT (0.47) | RAB9ANPC1MAPTPDPK1AURKA | |
| SCHEMBL7985455 | 0.87 | JAK3 (0.44) | RAB9ANPC1PDPK1KDRKMT2A | |
| SCHEMBL6982836 | 0.87 | JAK3 (0.44) | RAB9ANPC1PDPK1KDRKMT2A | |
| SCHEMBL7085728 | 0.85 | PTPN1 (0.44) | RAB9ANPC1MAPTPDPK1AURKA |
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 |