Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20650160 | 0.86 | TNKS (0.35) | TNKSPARP1TNKS2HDAC6PARP2 | |
| SCHEMBL20650725 | 0.85 | TNKS (0.32) | TNKSPARP1TNKS2HDAC6PARP2 | |
| SCHEMBL21021025 | 0.85 | DHFR (0.34) | MCL1TNKSPARP1TNKS2HDAC6 | |
| SCHEMBL20650419 | 0.84 | MCL1 (0.40) | MCL1 | |
| SCHEMBL20649814 | 0.84 | TNKS (0.40) | TNKSPARP1TNKS2HDAC6PARP2 | |
| SCHEMBL20650300 | 0.83 | MCL1 (0.34) | MCL1 | |
| SCHEMBL20650408 | 0.83 | TNKS (0.33) | TNKSPARP1TNKS2HDAC6PARP2 | |
| SCHEMBL20650391 | 0.83 | TNKS (0.30) | TNKSPARP1TNKS2HDAC6PARP2 | |
| SCHEMBL20650298 | 0.82 | MCL1 (0.33) | MCL1 | |
| SCHEMBL23967895 | 0.82 | ALDH1A1 (0.36) | — |
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-3428152-B1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2021-11-03 | — | — | EP | disclosed |
| EP-3428152-A1 | COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME | LG Chem, Ltd. (KR) | 2019-01-16 | — | — | EP | disclosed |