Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19984832 | 0.85 | KMT2A (0.47) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984797 | 0.81 | KMT2A (0.44) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984969 | 0.76 | CTSS (0.51) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984808 | 0.73 | EGFR (0.50) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984789 | 0.70 | APLNR (0.54) | KMT2AALDH1A1HPGDSMN1; SMN2LMNA | |
| SCHEMBL19984976 | 0.69 | APLNR (0.54) | KMT2AHPGDMAPK1 | |
| SCHEMBL19984821 | 0.69 | CTSA (0.46) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984815 | 0.69 | KMT2A (0.48) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL13073875 | 0.69 | PTK2 (0.59) | KMT2AALDH1A1NPC1THRBHPGD | |
| SCHEMBL19984851 | 0.68 | CTSS (0.43) | KMT2AALDH1A1NPC1THRBHPGD |
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 |