Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19524790 | 0.92 | ADORA2A (0.39) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17995350 | 0.91 | ADORA2A (0.46) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17995348 | 0.88 | ADORA2A (0.44) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17952699 | 0.88 | ADORA2A (0.46) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL20706111 | 0.84 | ADORA2A (0.46) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17467389 | 0.84 | ADORA2A (0.41) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17467391 | 0.84 | ADORA2A (0.41) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17299033 | 0.81 | ADORA2A (0.39) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL17995356 | 0.81 | ADORA2A (0.43) | ADORA2AADORA1PNMTKDRACHE | |
| SCHEMBL25068598 | 0.80 | ADORA2A (0.40) | ADORA2AADORA1PNMTKDRACHE |
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-4074706-A1 | DEUTERATED HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DEVICE | LG Display Co., Ltd. (KR) | 2022-10-19 | — | — | EP | disclosed |
| EP-3604298-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME | Heesung Material Ltd. (KR) | 2020-02-05 | — | — | EP | disclosed |