Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.69 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.69 |
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.65 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.65 |
| ▸ | MEN1 | O00255 | 5/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | TDP2 | O95551 | 1/20 | 0.57 |
| ▸ | FGB | P02675 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL30996045 | 0.81 | MAPT (0.62) | HDAC1HDAC6MEN1KMT2AKDM4E | |
| SCHEMBL31020169 | 0.80 | KMT2A (0.69) | HDAC1HDAC6HSP90AA1HSP90AB1MEN1 | |
| SCHEMBL17792862 | 0.80 | HSP90AA1 (0.93) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E | |
| SCHEMBL21855430 | 0.80 | KMT2A (0.69) | HDAC1HDAC6HSP90AA1HSP90AB1MEN1 | |
| SCHEMBL8893299 | 0.79 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E | |
| SCHEMBL12470224 | 0.79 | PKM (0.59) | HDAC1HDAC6HSP90AA1HSP90AB1MEN1 | |
| SCHEMBL8891233 | 0.78 | HSP90AA1 (0.98) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E | |
| SCHEMBL8900580 | 0.78 | HSP90AA1 (0.98) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E | |
| SCHEMBL8891243 | 0.78 | HSP90AA1 (0.98) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E | |
| SCHEMBL8891533 | 0.78 | HSP90AA1 (0.98) | HSP90AA1HSP90AB1MEN1KMT2AKDM4E |
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-2012048894-A1 | HYBRID COMPOUNDS OF 4- AND 8-AMINOQUINOLINES FOR THE PROPHYLACTIC AND THERAPEUTIC TREATMENT OF MALARIA AND OTHER PARASITIC DISEASES | JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) | 2012-04-19 | — | — | WO | disclosed |