Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 7/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4631032 | 0.85 | EPHX1 (0.42) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL4592660 | 0.79 | EPHX1 (0.42) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL282155 | 0.79 | EPHX1 (0.44) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL5959811 | 0.79 | EPHX1 (0.44) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL1840802 | 0.79 | EPHX1 (0.44) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL4602214 | 0.78 | EPHX1 (0.41) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL7404539 | 0.78 | ACHE (0.46) | EPHX1ALDH1A1ACHE | |
| SCHEMBL8764308 | 0.78 | EPHX1 (0.43) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL19145239 | 0.76 | EPHX1 (0.42) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD | |
| SCHEMBL8303799 | 0.76 | EPHX1 (0.42) | EPHX1SMN1; SMN2ALDH1A1NPC1HPGD |
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-2523948-A1 | PRO-DRUGS OF (E) -7- (3- (2-AMINO-1-FLUOROETHYLIDENE) PIPERIDIN-1-YL) -1-CYCLOPROPYL-6-FLUORO-8-METHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID | Janssen Pharmaceutica, N.V. (BE) | 2012-11-21 | — | — | EP | disclosed |
| WO-2011084922-A1 | PRO-DRUGS OF (E) -7- (3- (2-AMINO-1-FLUOROETHYLIDENE) PIPERIDIN-1-YL) -1-CYCLOPROPYL-6-FLUORO-8-METHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID | JANSSEN PHARMACEUTICA NV (BE) | 2011-07-14 | — | — | WO | disclosed |