Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | POLA1 | P09884 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.32 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | DGKA | P23743 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL28340556 | 0.80 | POLB (0.35) | CNR1POLBPOLA1LPAR1CNR2 | |
| SCHEMBL28340337 | 0.80 | ALDH1A1 (0.33) | CNR1POLBPOLA1ALOX5OXER1 | |
| SCHEMBL28340332 | 0.79 | EP300 (0.41) | ATMHCAR2MAPTNPSR1POLB | |
| SCHEMBL28340316 | 0.78 | POLB (0.39) | CNR1POLBPOLA1ALOX5OXER1 | |
| SCHEMBL28342840 | 0.76 | ZDHHC2 (0.52) | ATMCNR1RAB9APOLBCNR2 | |
| SCHEMBL28880673 | 0.73 | ATM (0.53) | ATMHCAR2CNR1MAPTRAB9A | |
| SCHEMBL10886504 | 0.72 | ATM (0.53) | ATMHCAR2CNR1MAPTHPGD | |
| SCHEMBL560322 | 0.72 | ATM (0.80) | ATMHCAR2MAPTRAB9ANPSR1 | |
| SCHEMBL560712 | 0.72 | ATM (0.80) | ATMHCAR2MAPTRAB9ANPSR1 | |
| SCHEMBL28340363 | 0.72 | ATM (0.50) | ATMHCAR2MAPTRAB9ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110642737-B | Preparation method of amide-substituted (E, E) -configuration branched conjugated diene derivative | 杭州师范大学 | 2022-08-05 | — | — | CN | disclosed |