Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | BAD | Q92934 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL19830024 | 1.00 | CES1 (0.41) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL20112700 | 0.76 | CES1 (0.52) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL599446 | 0.76 | CES1 (0.43) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL19995842 | 0.76 | NOS3 (0.44) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL630475 | 0.76 | BCL2L1 (0.52) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL29660392 | 0.75 | HTR2A (0.41) | LMNAMAPTALDH1A1 | |
| SCHEMBL6168691 | 0.75 | HTR2A (0.41) | LMNAMAPTALDH1A1 | |
| SCHEMBL1278375 | 0.74 | BCL2L1 (0.52) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL24556384 | 0.73 | CES1 (0.41) | CES1BCL2L1BADNOS3NOS1 | |
| SCHEMBL18973499 | 0.73 | CES1 (0.41) | CES1BCL2L1BADNOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117616006-A | Compound and organic light emitting device comprising the same | 株式会社LG化学 | 2024-02-27 | — | — | CN | disclosed |