Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | TOP1 | P11387 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CLK2 | P49760 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3198669 | 0.81 | KDM4E (0.42) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL10306167 | 0.80 | KDM4E (0.42) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL4458208 | 0.79 | KCNH2 (0.69) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL4365316 | 0.79 | KCNH2 (0.69) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL4460676 | 0.79 | KCNH2 (0.69) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL6594710 | 0.79 | PIM3 (0.39) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL14739070 | 0.79 | PIM3 (0.39) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL10719453 | 0.79 | KDM4E (0.50) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| SCHEMBL4378511 | 0.79 | TOP1 (0.60) | KCNH2TOP1ALDH1A1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL2364485 | 0.79 | KCNH2 (0.68) | KCNH2TOP1ALDH1A1KDM4EHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1694667-A2 | POLYMORPHS OF 1-CYCLOPROPYL-6-FLUORO-8-METHOXY-7-(4-AMINO-3, 3-DIMETHYLPIPERIDIN-1-YL)-1,4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID HYDROCHLORIDE AND MESALYTE SALTS | Wockhardt Limited (IN) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005066154-A2 | POLYMORPHS OF 1-CYCLOPROPYL-6-FUORO-8-METHOXY-7-(4-AMINO-3, 3-DIMETHYLPIPERIDIN-1-YL) -1, 4-DIHYDRO-4-OXO-QUINOLINE-3-CARBOXYLIC ACID HYDROCHLORIDE AND MESALYTE SALTS | WOCKHARDT LIMITED (IN) | 2005-07-21 | — | — | WO | disclosed |