Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | IAPP | P10997 | 4/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | PON1 | P27169 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20153010 | 0.88 | LTB4R (0.45) | NPSR1IAPPTRPV1SLC5A1SLC5A2 | |
| SCHEMBL20152941 | 0.88 | NPSR1 (0.47) | BACE1NPSR1IAPPTRPV1MCL1 | |
| SCHEMBL20153011 | 0.79 | IAPP (0.40) | NPSR1IAPPTRPV1MAPTFFAR1 | |
| SCHEMBL20153022 | 0.78 | HSD17B1 (0.43) | BACE1SLC5A1SLC5A2HSD17B1FFAR1 | |
| SCHEMBL20153001 | 0.75 | BACE1 (0.41) | BACE1ALDH1A1KDM4ETDP1PON1 | |
| SCHEMBL27927872 | 0.74 | NPSR1 (0.48) | NPSR1IAPPALDH1A1TDP1L3MBTL1 | |
| SCHEMBL20153033 | 0.73 | NPSR1 (0.48) | NPSR1IAPPTRPV1MAPT | |
| SCHEMBL27696939 | 0.73 | POLB (0.47) | IAPPFFAR1FFAR4 | |
| SCHEMBL14283893 | 0.71 | BACE1 (0.55) | BACE1NPSR1MCL1ALDH1A1KDM4E | |
| SCHEMBL20152915 | 0.69 | NPSR1 (0.47) | NPSR1IAPP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086197-A1 | CATALYTIC ASYMMETRIC SYNTHESIS METHOD FOR CHIRAL SPINOL DERIVATE | 南方科技大学 | 2018-05-17 | — | — | WO | disclosed |