Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 5/20 | 0.36 |
| ▸ | TSPO | P30536 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12455241 | 0.99 | MAPK1 (0.34) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL19061207 | 0.97 | PDK2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL12455255 | 0.96 | PDK2 (0.34) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL19061795 | 0.96 | SMN1; SMN2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385145 | 0.95 | PDK2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385149 | 0.95 | PDK2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385124 | 0.95 | PDK2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385120 | 0.95 | PDK2 (0.33) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385154 | 0.94 | NPY5R (0.31) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL18385122 | 0.94 | NPY5R (0.31) | PDK2TSPOMAPK1KDM4ESMN1; SMN2 |
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-2017111389-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE INCLUDING SAME | 주식회사 두산 | 2017-06-29 | — | — | WO | disclosed |