Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22430578 | 0.76 | MEN1 (0.64) | EPHX1KCNK3LMNACYP3A4CYP2D6 | |
| SCHEMBL8008669 | 0.75 | GRK2 (0.61) | CYP1A2RECQLMCL1KMT2AALDH1A1 | |
| SCHEMBL22423670 | 0.75 | MEN1 (0.68) | EPHX1KCNK3LMNAMEN1KMT2A | |
| SCHEMBL23835701 | 0.75 | EPHX1 (0.55) | EPHX1KCNK3LMNACYP3A4CYP2D6 | |
| SCHEMBL10742560 | 0.74 | CYP1A2 (0.68) | EPHX1CYP1A2RECQLLMNAMCL1 | |
| SCHEMBL1719455 | 0.74 | MCL1 (0.64) | CYP1A2MCL1MEN1KMT2AMAPK1 | |
| SCHEMBL12821059 | 0.72 | MCL1 (0.54) | CYP1A2RECQLMCL1MEN1KMT2A | |
| SCHEMBL14826669 | 0.72 | MEN1 (0.52) | EPHX1KCNK3LMNACYP3A4CYP2D6 | |
| SCHEMBL2616379 | 0.72 | EPHX1 (0.51) | EPHX1KCNK3LMNACYP3A4CYP2D6 | |
| SCHEMBL3261012 | 0.72 | EPHX1 (0.51) | EPHX1KCNK3LMNACYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106928126-B | Amide derivative, preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2019-12-20 | — | — | CN | disclosed |
| CN-106928126-A | A kind of amide derivatives and preparation method thereof and application pharmaceutically | 四川海思科制药有限公司 | 2017-07-07 | — | — | CN | disclosed |