Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 5/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27879990 | 0.91 | MAPK14 (0.43) | MAPK14HIF1ALMNAHTTCYP3A4 | |
| SCHEMBL692005 | 0.82 | PPARA (0.49) | MAPK14HIF1ALMNAHTTCYP3A4 | |
| SCHEMBL691959 | 0.77 | MAPK14 (0.44) | MAPK14HIF1ALMNAHTTSMN1; SMN2 | |
| SCHEMBL692489 | 0.74 | MAPK14 (0.45) | MAPK14HIF1ALMNAHTTCYP3A4 | |
| SCHEMBL12285316 | 0.74 | MECP2 (0.47) | MAPK14HIF1ALMNAHTTCYP3A4 | |
| SCHEMBL9613113 | 0.70 | MAPK14 (0.46) | MAPK14HIF1ALMNAHTTCYP3A4 | |
| SCHEMBL692923 | 0.67 | FFAR1 (0.45) | MAPK14HIF1AMMP13MAPTRAB9A | |
| SCHEMBL28612286 | 0.66 | CTSL (0.52) | LMNASMN1; SMN2KMT2AMEN1HPGD | |
| SCHEMBL691544 | 0.66 | PPARA (0.54) | MAPK14 | |
| SCHEMBL690195 | 0.66 | AKR1C2 (0.46) | MAPK14LMNASMN1; SMN2HPGDALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102802623-A | Compounds, compositions and methods comprising 1,3,4-oxadiazole derivatives | INST ONEWORLD HEALTH | 2012-11-28 | — | — | CN | claimed |
| CN-102802623-A | Compounds, compositions and methods comprising 1,3,4-oxadiazole derivatives | INST ONEWORLD HEALTH | 2012-11-28 | — | — | CN | disclosed |