Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.65 |
| ▸ | HPGD | P15428 | 4/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.64 |
| ▸ | POLB | P06746 | 3/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.64 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.64 |
| ▸ | CLK2 | P49760 | 1/20 | 0.64 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13496638 | 0.91 | KDM4E (0.66) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL22477366 | 0.86 | KDM4E (0.63) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL28391101 | 0.86 | KCNH2 (0.63) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL30415810 | 0.86 | KCNH2 (0.63) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL8940663 | 0.85 | KCNH2 (0.67) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL26544924 | 0.83 | KDM4E (0.43) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL8854414 | 0.82 | KDM4E (0.65) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL9185212 | 0.82 | KCNH2 (0.69) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| Trifluoroacetic Acid SCHEMBL8388928 | 0.81 | KCNH2 (0.61) | KDM4EALDH1A1HPGDHSD17B10MEN1 | |
| SCHEMBL3975860 | 0.81 | KCNH2 (0.67) | KDM4EALDH1A1HPGDHSD17B10MEN1 |
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-2998304-B1 | METHOD FOR PRODUCING (1-CYCLOPROPYL-6-FLUORO-1,4-DIHYDRO-8-METHOXY-7-[(4AS,7AS)-OCTAHYDRO-6H-PYRROLO[3,4-B]PYRIDIN-6-YL]-4-OXO-3-QUINOLINE-CARBOXYLIC ACID | DERKACH NATALIIA MYKOLAIVNA (UA) | 2017-08-30 | — | — | EP | disclosed |