Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 5/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9099385 | 0.77 | DRD2 (0.49) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL7888666 | 0.77 | KEAP1 (0.47) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL7896659 | 0.76 | DRD2 (0.48) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL7888633 | 0.76 | KEAP1 (0.50) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL5795215 | 0.76 | KEAP1 (0.50) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL17872002 | 0.76 | KEAP1 (0.46) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL483516 | 0.75 | MAPT (0.49) | KCNQ2CYP1A2CYP3A4CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL11277803 | 0.75 | KEAP1 (0.44) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL17871763 | 0.75 | KEAP1 (0.49) | KEAP1KCNQ2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL4547918 | 0.72 | GAA (0.48) | KEAP1KCNQ2MAPK1HTR1AL3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114437068-A | Naphthyridine derivative and application thereof as monoamine oxidase inhibitor | 深圳市儿童医院 | 2022-05-06 | — | — | CN | disclosed |
| CN-101142181-B | Process for the preparation of enantiomerically pure 4-pyrrolidinophenylbenzyl ether derivatives | HOFFMANN LA ROCHE | 2011-05-04 | — | — | CN | disclosed |
| CN-101142181-A | Process for the preparation of enantiomerically pure 4-pyrrolidinophenylbenzyl ether derivatives | HOFFMANN LA ROCHE (CH) | 2008-03-12 | — | — | CN | disclosed |
| EP-1861362-A1 | METHOD FOR PREPARING ENANTIOMERICALLY PURE 4-PYRROLIDINOPHENYL, BENZYL, ETHER DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006097197-A1 | METHOD FOR PREPARING ENANTIOMERICALLY PURE 4-PYRROLIDINOPHENYL, BENZYL, ETHER DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2006-09-21 | — | — | WO | disclosed |