Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | VCP | P55072 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16613485 | 0.97 | DHODH (0.41) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613533 | 0.92 | DHODH (0.40) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613534 | 0.91 | DHODH (0.39) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613657 | 0.89 | ADORA2A (0.48) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613531 | 0.89 | ADORA2A (0.39) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613566 | 0.88 | KDM4E (0.40) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613469 | 0.88 | VCP (0.36) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613722 | 0.87 | KDM4E (0.39) | ADORA2AVCPKDM4EALDH1A1HPGD | |
| SCHEMBL16613656 | 0.86 | VCP (0.35) | ADORA2AVCPALDH1A1DHODH | |
| SCHEMBL16613713 | 0.86 | DHODH (0.36) | ADORA2AVCPKDM4EALDH1A1HPGD |
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-2015047058-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2015-04-02 | — | — | WO | disclosed |