Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 5/20 | 0.45 |
| ▸ | BCHE | P06276 | 4/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4748546 | 0.81 | ERBB2 (0.49) | ERBB2ACHEBCHEPDGFRBL3MBTL1 | |
| SCHEMBL10251583 | 0.81 | NCF1 (0.53) | ERBB2ACHEBCHEL3MBTL1MAPT | |
| SCHEMBL3899573 | 0.80 | IP6K1 (0.56) | ERBB2NPC1RAB9AEGFRHPGD | |
| SCHEMBL30827905 | 0.79 | ACHE (0.49) | ACHEBCHEL3MBTL1MAPTTDP1 | |
| SCHEMBL4745132 | 0.79 | ACHE (0.49) | ACHEBCHEL3MBTL1MAPTTDP1 | |
| SCHEMBL282245 | 0.78 | LMNA (0.58) | MAPTLMNAKDM4EMAPK1CYP1A2 | |
| SCHEMBL29729443 | 0.78 | LMNA (0.58) | MAPTLMNAKDM4EMAPK1CYP1A2 | |
| SCHEMBL32684711 | 0.77 | LMNA (0.69) | ERBB2PDGFRBSMN1; SMN2LMNAKDM4E | |
| SCHEMBL3647767 | 0.76 | MAPT (0.61) | ACHEBCHEL3MBTL1MAPTTDP1 | |
| SCHEMBL31121065 | 0.75 | PIK3CA (0.59) | L3MBTL1MAPTDYRK1BEGFRKDM4E |
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-2008117079-A1 | ANTIMICROBIAL COMPOUNDS BASED UPON 4-AMINOQUINOLINE | HELPERBY THERAPEUTICS LIMITED (GB) | 2008-10-02 | — | — | WO | disclosed |