Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.36 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL250810 | 1.00 | KDM4E (0.46) | KDM4ECYP2A6ALDH1A1NPSR1TRPV1 | |
| SCHEMBL2555659 | 0.84 | KDM4E (0.40) | KDM4ECYP2A6ALDH1A1NPSR1TRPV1 | |
| SCHEMBL932830 | 0.84 | ALDH1A1 (0.40) | KDM4ECYP2A6ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL30971683 | 0.84 | KDM4E (0.40) | KDM4ECYP2A6ALDH1A1NPSR1TRPV1 | |
| SCHEMBL30798672 | 0.84 | ALDH1A1 (0.40) | KDM4ECYP2A6ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL20304488 | 0.81 | CYP2A6 (0.38) | KDM4ECYP2A6ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL20304829 | 0.81 | KDM4E (0.41) | KDM4ECYP2A6ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL7996261 | 0.81 | ALDH1A1 (0.40) | KDM4ECYP2A6ALDH1A1L3MBTL1KCNJ1 | |
| SCHEMBL20304772 | 0.80 | CHRNA7 (0.45) | KDM4ECYP2A6ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL336320 | 0.79 | TRPV4 (0.52) | KDM4EALDH1A1TRPV1L3MBTL1KCNJ1 |
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 |