Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL12328506 | 0.76 | — | — | |
| SCHEMBL15034651 | 0.70 | ADORA2A (0.49) | ADORA2APDK1KDM4EALDH1A1PDK2 | |
| SCHEMBL16542821 | 0.69 | ADORA2A (0.47) | ADORA2APDK1KDM4EALDH1A1NUDT1 | |
| SCHEMBL29986593 | 0.69 | ADORA2A (0.47) | ADORA2APDK1KDM4EALDH1A1NUDT1 | |
| SCHEMBL16542819 | 0.68 | ADORA2A (0.57) | ADORA2AKDM4EALDH1A1NUDT1LMNA | |
| SCHEMBL29986553 | 0.68 | ADORA2A (0.57) | ADORA2AKDM4EALDH1A1NUDT1LMNA | |
| SCHEMBL1773091 | 0.68 | NUDT1 (0.60) | ADORA2AKDM4EALDH1A1NUDT1LMNA | |
| SCHEMBL19986162 | 0.68 | ADORA2A (0.46) | ADORA2APDK1KDM4EALDH1A1PDK2 | |
| SCHEMBL23543842 | 0.68 | PDK1 (0.33) | ADORA2APDK1KDM4EALDH1A1PDK2 | |
| SCHEMBL18235113 | 0.67 | ADORA2A (0.49) | ADORA2AKDM4EALDH1A1NUDT1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3351523-B1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME | LG CHEMICAL LTD (KR) | 2020-11-04 | — | — | EP | disclosed |