Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28096012 | 0.88 | PDE4A (0.48) | PDE4APDE4BPDE4CPDE4DABCB1 | |
| SCHEMBL28096083 | 0.83 | MAPT (0.49) | PDE4APDE4BPDE4CPDE4DS1PR1 | |
| SCHEMBL17279690 | 0.82 | NR1H2 (0.60) | NR1H2NR1H3KDM4ETSHRPOLB | |
| Hydrochloric Acid SCHEMBL6581075 | 0.80 | ADORA2A (0.58) | PDE4APDE4BPDE4CPDE4DS1PR1 | |
| SCHEMBL17280055 | 0.79 | KDM4E (0.60) | S1PR1NR1H2NR1H3KDM4ETSHR | |
| SCHEMBL15117081 | 0.79 | NR1H2 (0.63) | S1PR1NR1H2NR1H3KDM4ETSHR | |
| SCHEMBL28095606 | 0.77 | KDM4E (0.55) | S1PR1NR1H2NR1H3KDM4ETSHR | |
| SCHEMBL28096010 | 0.77 | KDM4E (0.55) | S1PR1KDM4ETSHRPOLBHSD17B10 | |
| SCHEMBL28075492 | 0.77 | KDM4E (0.62) | S1PR1KDM4ETSHRPOLBHSD17B10 | |
| SCHEMBL28075481 | 0.76 | KDM4E (0.57) | S1PR1NR1H2NR1H3KDM4ETSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106243130-A | 3,6 diaryl [1,2,4] triazole also [3,4 b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2016-12-21 | — | — | CN | claimed |
| CN-106243130-B | 3,6- diaryl-[1,2,4] triazole simultaneously [3,4-b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2019-03-01 | — | — | CN | disclosed |
| CN-106243130-A | 3,6 diaryl [1,2,4] triazole also [3,4 b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2016-12-21 | — | — | CN | disclosed |