Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19984848 | 0.86 | ALDH1A1 (0.43) | TSHRALOX15HSD17B10MAPTNPC1 | |
| SCHEMBL19984980 | 0.77 | PIEZO1 (0.38) | MAPTNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL19984843 | 0.73 | NAMPT (0.49) | TSHRMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL14517931 | 0.65 | KDM4E (0.74) | TSHRTP53MAPTNPC1RAB9A | |
| SCHEMBL30511404 | 0.62 | ADAMTS4 (0.51) | NPC1RAB9AALDH1A1SMN1; SMN2HTT | |
| Benzene SCHEMBL11579880 | 0.61 | THRB (0.71) | TSHRTP53MAPTNPC1RAB9A | |
| SCHEMBL30511402 | 0.61 | ALDH1A1 (0.50) | TSHRALOX15HSD17B10TP53MAPT | |
| SCHEMBL14442613 | 0.61 | TP53 (0.84) | TSHRALOX15HSD17B10TP53MAPT | |
| SCHEMBL19449478 | 0.60 | THRB (0.72) | TSHRTP53MAPTNPC1RAB9A | |
| SCHEMBL4893387 | 0.59 | TP53 (0.87) | TSHRALOX15HSD17B10TP53MAPT |
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-2018051255-A1 | CYCLIC SUBSTITUTED-1,3,4-OXADIAZOLE AND THIADIAZOLE COMPOUNDS AS IMMUNOMODULATORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2018-03-22 | — | — | WO | disclosed |