Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 3/20 | 0.34 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | TYK2 | P29597 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | HCK | P08631 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4643990 | 0.90 | PARP1 (0.40) | PARP1MKNK1MKNK2NOTUMRORC | |
| SCHEMBL14161471 | 0.87 | KDM4E (0.38) | NOTUMPDK2KMT2AKDM4ELMNA | |
| SCHEMBL4642110 | 0.78 | KDM4E (0.40) | NOTUMPDK2KMT2AKDM4ELMNA | |
| SCHEMBL4640368 | 0.75 | NOTUM (0.39) | NOTUMPDK2KMT2AKDM4ELMNA | |
| SCHEMBL4640367 | 0.74 | HTT (0.48) | RORCJAK2JAK1TYK2JAK3 | |
| SCHEMBL4736986 | 0.71 | MKNK1 (0.43) | MKNK1MKNK2PDK2KMT2AKDM4E | |
| SCHEMBL3945829 | 0.70 | KDM4E (0.45) | KDM4ELMNAALDH1A1HSD17B10 | |
| SCHEMBL3935043 | 0.70 | MAPK1 (0.42) | KMT2AKDM4ELMNAMAPTHTT | |
| SCHEMBL14161476 | 0.69 | PARP1 (0.40) | PARP1PIK3CAALDH1A1 | |
| SCHEMBL14098995 | 0.68 | PARP1 (0.53) | PARP1RORC |
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-1956016-A1 | Bicyclic acyltryptophanols | Bayer Schering Pharma Aktiengesellschaft (DE) | 2008-08-13 | — | — | EP | disclosed |