Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.64 |
| ▸ | MAOB | P27338 | 4/20 | 0.54 |
| ▸ | AR | P10275 | 2/20 | 0.53 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.52 |
| ▸ | CXCL12 | P48061 | 4/20 | 0.51 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL996824 | 1.00 | ABCG2 (0.64) | ABCG2MAOBARMAOACAPN1 | |
| SCHEMBL997363 | 0.89 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AKDM4EALDH1A1 | |
| SCHEMBL997364 | 0.89 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AKDM4EALDH1A1 | |
| SCHEMBL997194 | 0.87 | MAPT (0.62) | ABCG2MAOBMAOACAPN1PARP1 | |
| SCHEMBL997192 | 0.87 | MAPT (0.62) | ABCG2MAOBMAOACAPN1PARP1 | |
| SCHEMBL995788 | 0.87 | ABCB1 (0.51) | ABCG2MAOBARMAOAMAPT | |
| SCHEMBL995789 | 0.87 | ABCB1 (0.51) | ABCG2MAOBARMAOAMAPT | |
| SCHEMBL997861 | 0.86 | PDE4A (0.64) | ABCG2MAOBARMAPTTNFRSF1A | |
| SCHEMBL997864 | 0.86 | PDE4A (0.64) | ABCG2MAOBARMAPTTNFRSF1A | |
| SCHEMBL998254 | 0.84 | ABCG2 (0.67) | ABCG2MAPTTNFRSF1AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | claimed |
| WO-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |