Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL17236434 | 1.00 | KDM4E (0.43) | KDM4ETDP1ESR1HTTTSHR | |
| SCHEMBL13324326 | 0.82 | KDM4E (0.49) | KDM4ETDP1ESR1HTTTSHR | |
| SCHEMBL4599515 | 0.79 | TDP1 (0.38) | KDM4ETDP1ESR1HTTTSHR | |
| SCHEMBL17167770 | 0.78 | TDP1 (0.47) | KDM4ETDP1ESR1HTTTSHR | |
| SCHEMBL29956202 | 0.77 | ENPP2 (0.45) | KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL5859114 | 0.77 | ENPP2 (0.45) | KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL19777818 | 0.76 | TSHR (0.42) | KDM4ETSHRLMNAMAPTGAA | |
| SCHEMBL10027413 | 0.76 | — | — | |
| SCHEMBL16328148 | 0.75 | TDP1 (0.49) | KDM4ETDP1ESR1HTTTSHR | |
| SCHEMBL9704738 | 0.75 | ESR1 (0.51) | KDM4ETDP1ESR1HTTTSHR |
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 |