Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 3/20 | 0.35 |
| ▸ | CES1 | P23141 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 3/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7710925 | 0.85 | CYP3A4 (0.38) | ATMCES2CES1CYP3A4LMNA | |
| SCHEMBL19871616 | 0.81 | MAPT (0.39) | MAPT | |
| SCHEMBL22315200 | 0.81 | AKT1 (0.35) | ATMLMNAAKT1CHRNB2CHRNB4 | |
| SCHEMBL6838562 | 0.81 | HTT (0.36) | CYP3A4CYP1A2CYP2D6KMT2A | |
| SCHEMBL6838561 | 0.81 | HTT (0.36) | CYP3A4CYP1A2CYP2D6KMT2A | |
| SCHEMBL28085607 | 0.81 | ATM (0.38) | ATMCES2CES1CYP3A4LMNA | |
| SCHEMBL18460837 | 0.81 | ATM (0.38) | ATMCES2CES1CYP3A4LMNA | |
| SCHEMBL13012265 | 0.79 | AKT1 (0.38) | ATMCES2CES1LMNAAKT1 | |
| SCHEMBL30924817 | 0.79 | ATM (0.37) | ATMCES2CES1LMNAAKT1 | |
| SCHEMBL15826777 | 0.79 | ACHE (0.32) | — |
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-3053910-B1 | ANILINE DERIVATIVES AND USES THEREOF | NISSAN CHEMICAL CORP (JP) | 2021-04-28 | — | — | EP | disclosed |
| US-20200343453-A1 | LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING ELEMENT, AND COMPOUND | Kyushu University, University Corporation (JP) | 2020-10-29 | — | — | US | disclosed |