Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | BCKDK | O14874 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22330006 | 0.95 | ENPP2 (0.44) | ENPP2KDM4EBCKDKMCL1RXFP1 | |
| SCHEMBL30408508 | 0.81 | CA2 (0.41) | ENPP2KDM4ETTRALDH1A1 | |
| SCHEMBL1792101 | 0.81 | CA2 (0.41) | ENPP2KDM4ETTRALDH1A1 | |
| SCHEMBL29418151 | 0.80 | GPR3 (0.54) | ENPP2KDM4EMAPTRAB9AALDH1A1 | |
| SCHEMBL2158388 | 0.80 | GPR3 (0.54) | ENPP2KDM4EMAPTRAB9AALDH1A1 | |
| SCHEMBL3258493 | 0.79 | KDM4E (0.61) | KDM4ECYP2A6ROCK1PIM1PIM2 | |
| SCHEMBL24343656 | 0.79 | KDM4E (0.46) | KDM4EBCKDKMCL1RXFP1CYP2A6 | |
| SCHEMBL25490982 | 0.78 | MAPT (0.44) | KDM4EMAPTRAB9AALDH1A1HPGD | |
| SCHEMBL31818 | 0.77 | GPR3 (0.54) | ENPP2KDM4EMAPTRAB9AALDH1A1 | |
| SCHEMBL29395493 | 0.76 | CA1 (0.53) | ENPP2KDM4EMAPTRAB9AALDH1A1 |
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-2020235976-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 (KR) | 2020-11-26 | — | — | WO | disclosed |