Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21583363 | 0.93 | KDM4E (0.34) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A | |
| SCHEMBL21583320 | 0.90 | — | — | |
| SCHEMBL22841642 | 0.87 | KDM4E (0.32) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A | |
| SCHEMBL21583347 | 0.85 | KDM4E (0.31) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A | |
| SCHEMBL22841744 | 0.82 | — | — | |
| SCHEMBL21583411 | 0.82 | RAB9A (0.41) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A | |
| SCHEMBL19299275 | 0.81 | — | — | |
| SCHEMBL22842361 | 0.79 | — | — | |
| SCHEMBL21583272 | 0.78 | KDM4E (0.40) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A | |
| SCHEMBL19298331 | 0.76 | RAB9A (0.41) | KDM4ESMN1; SMN2NPC1ALDH1A1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3575290-B1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING SAME | LG CHEMICAL LTD (KR) | 2020-11-18 | — | — | EP | disclosed |
| EP-3575290-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING SAME | LG Chem, Ltd. (KR) | 2019-12-04 | — | — | EP | disclosed |