Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.67 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.67 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.63 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.63 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3101728 | 0.80 | HDAC6 (1.00) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL13930792 | 0.80 | CASP3 (0.65) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL436150 | 0.77 | S1PR1 (1.00) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL29389224 | 0.77 | S1PR1 (1.00) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL26096204 | 0.76 | NR1H4 (0.70) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL15042804 | 0.76 | S1PR1 (0.78) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL13930791 | 0.74 | NPC1 (0.61) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL24800013 | 0.73 | NPC1 (0.63) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL15219436 | 0.73 | L3MBTL1 (0.70) | HDAC6HDAC4HDAC1S1PR1ALOX15 | |
| SCHEMBL18292540 | 0.72 | MAPT (0.63) | HDAC6HDAC4HDAC1S1PR1ALOX15 |
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-112402610-A | New use of sphingosine-1-phosphate receptor modulator in preparation of medicine for treating diabetes | 睿阜隆(杭州)生物医药有限公司 | 2021-02-26 | — | — | CN | disclosed |