Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | METAP2 | P50579 | 3/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | PRKCB | P05771 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | MAT2A | P31153 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19061240 | 0.96 | PDK2 (0.40) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL19061232 | 0.94 | PDK2 (0.41) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL19061533 | 0.94 | CYP1A2 (0.39) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL17427720 | 0.93 | CYP1A2 (0.38) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL19061715 | 0.90 | PDK2 (0.36) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL19061284 | 0.89 | PDK2 (0.40) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL19061797 | 0.88 | L3MBTL1 (0.45) | PDK2HTTKDM4EATML3MBTL1 | |
| SCHEMBL19061501 | 0.88 | PDK2 (0.41) | CYP1A2METAP2PDK2MDM2CYP11B2 | |
| SCHEMBL802605 | 0.87 | CYP1A2 (0.40) | CYP1A2METAP2MDM2CYP11B2ALOX12 | |
| SCHEMBL2603500 | 0.87 | CYP1A2 (0.40) | CYP1A2METAP2MDM2CYP11B2ALOX12 |
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 |