Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 1/20 | 0.49 |
| ▸ | ERN1 | O75460 | 1/20 | 0.49 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.49 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.49 |
| ▸ | ATR | Q13535 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2198998 | 1.00 | TLR2 (0.49) | TLR2ERN1TLR1TLR6ATR | |
| SCHEMBL29991677 | 0.87 | ATR (0.47) | ATRKDM4EALDH1A1GAADRD2 | |
| SCHEMBL29957958 | 0.83 | LCK (0.49) | ATRALDH1A1CA1 | |
| SCHEMBL29954566 | 0.82 | ERN1 (0.42) | ERN1ATRKDM4EALDH1A1LMNA | |
| SCHEMBL1677060 | 0.82 | ENPP2 (0.45) | ATRKDM4EALDH1A1GAADRD2 | |
| SCHEMBL29954888 | 0.82 | LCK (0.49) | ATRALDH1A1DRD2LMNAMAPT | |
| SCHEMBL2968874 | 0.82 | ERN1 (0.42) | ERN1ATRKDM4EALDH1A1LMNA | |
| SCHEMBL27484947 | 0.81 | ALDH1A1 (0.44) | ATRKDM4EALDH1A1GAADRD2 | |
| SCHEMBL31359208 | 0.81 | KDM4E (0.41) | TLR2ERN1TLR1TLR6ATR | |
| SCHEMBL729159 | 0.80 | ATR (0.42) | ATRKDM4EALDH1A1GAADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |