Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | XDH | P47989 | 3/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL25038573 | 0.95 | PIM1 (0.38) | PIM1XDHGRM5ADORA2AADORA1 | |
| SCHEMBL25038640 | 0.91 | XDH (0.40) | XDHGRM5ALDH1A1LMNAMEN1 | |
| SCHEMBL25038600 | 0.91 | XDH (0.39) | XDHGRM5ALDH1A1LMNAMEN1 | |
| SCHEMBL25038540 | 0.90 | PIM1 (0.39) | PIM1XDHGRM5FASNADORA2A | |
| SCHEMBL25038557 | 0.90 | XDH (0.41) | XDHGRM5ALDH1A1LMNAMEN1 | |
| SCHEMBL25038534 | 0.90 | XDH (0.39) | XDHGRM5ALDH1A1LMNAMEN1 | |
| SCHEMBL25038470 | 0.89 | PIM1 (0.37) | PIM1FASNADORA2AADORA1ABL1 | |
| SCHEMBL25037885 | 0.89 | XDH (0.39) | PIM1XDHFASNADORA2AADORA1 | |
| SCHEMBL25036075 | 0.88 | PIM1 (0.36) | PIM1FASNADORA2AADORA1ABL1 | |
| SCHEMBL25037888 | 0.88 | PIM1 (0.38) | PIM1XDHGRM5FASNADORA2A |
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-2023018267-A1 | NOVEL COMPOUND, AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-02-16 | — | — | WO | disclosed |