Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21743584 | 0.96 | ADORA3 (0.33) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743373 | 0.96 | MEN1 (0.33) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743633 | 0.95 | MEN1 (0.33) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743570 | 0.94 | ADORA3 (0.31) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743563 | 0.93 | ADORA3 (0.30) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743629 | 0.93 | ADORA3 (0.34) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743375 | 0.92 | ADORA3 (0.35) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL23814866 | 0.91 | ADORA3 (0.33) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL23814391 | 0.91 | ADORA3 (0.33) | ADORA3ALOX15TSHRADORA2AADORA2B | |
| SCHEMBL21743644 | 0.91 | MEN1 (0.31) | MEN1MAPTKMT2AKDM4ELMNA |
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-2020036313-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-02-20 | — | — | WO | disclosed |