Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | PGR | P06401 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAC2 | P15153 | 1/20 | 0.33 |
| ▸ | RAC3 | P60763 | 1/20 | 0.33 |
| ▸ | CDC42 | P60953 | 1/20 | 0.33 |
| ▸ | RAC1 | P63000 | 1/20 | 0.33 |
| ▸ | KHK | P50053 | 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 | |
|---|---|---|---|---|
| SCHEMBL16424918 | 0.92 | CYP17A1 (0.39) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425013 | 0.89 | CYP17A1 (0.41) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL19051864 | 0.88 | NR3C1 (0.39) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425027 | 0.87 | KDM4E (0.45) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425024 | 0.86 | CYP17A1 (0.36) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425008 | 0.86 | NR3C1 (0.43) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL19052214 | 0.85 | NR3C1 (0.39) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425043 | 0.85 | CYP17A1 (0.36) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL16425018 | 0.84 | NR3C1 (0.38) | CYP17A1CYP1A2NR3C1ATMKDM4E | |
| SCHEMBL20706857 | 0.84 | L3MBTL1 (0.47) | NR3C1ATMKDM4EL3MBTL1KMT2A |
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-2015012528-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | 주식회사 두산 (KR) | 2015-01-29 | — | — | WO | disclosed |