Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.37 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL22698298 | 0.84 | MEN1 (0.38) | ROCK1KMT2AATMMEN1PDE3B | |
| SCHEMBL19802290 | 0.81 | MEN1 (0.41) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL25463055 | 0.80 | MEN1 (0.35) | ROCK1KMT2AATMMEN1PDE3B | |
| SCHEMBL19802644 | 0.80 | F9 (0.36) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL20391967 | 0.80 | F9 (0.39) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL19802065 | 0.79 | F9 (0.39) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL19802881 | 0.79 | F9 (0.36) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL25646127 | 0.79 | PIM3 (0.38) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL24169841 | 0.79 | GPR3 (0.42) | ROCK1KMT2AATMMEN1LIMK1 | |
| SCHEMBL24169330 | 0.79 | GPR3 (0.42) | ROCK1KMT2AATMMEN1LIMK1 |
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-2019212287-A9 | COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME | 주식회사 엘지화학 (KR) | 2020-11-26 | — | — | WO | disclosed |