Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CTSA | P10619 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL19984849 | 0.93 | CTSA (0.43) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19984793 | 0.88 | KMT2A (0.41) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19984792 | 0.87 | KMT2A (0.41) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19866358 | 0.86 | VSIR (0.48) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL18078745 | 0.86 | VSIR (0.48) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19984807 | 0.80 | TP53 (0.43) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19984821 | 0.79 | CTSA (0.46) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL18078746 | 0.78 | KMT2A (0.43) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19866375 | 0.78 | KMT2A (0.43) | KMT2ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL19864347 | 0.76 | CD274 (0.50) | — |
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 |