Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | LCK | P06239 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | ERN1 | O75460 | 5/20 | 0.48 |
| ▸ | PRKDC | P78527 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4367355 | 1.00 | ALDH1A1 (0.62) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL11843446 | 0.86 | ALDH1A1 (0.49) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL10973608 | 0.85 | ALDH1A1 (0.62) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL14581612 | 0.84 | ALDH1A1 (0.52) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL19445561 | 0.84 | ALDH1A1 (0.60) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL3911024 | 0.82 | PRKDC (0.68) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| SCHEMBL12444067 | 0.82 | ALDH1A1 (0.64) | ALDH1A1KDM4ETDP1HPGDLCK | |
| SCHEMBL17632769 | 0.81 | ALDH1A1 (0.52) | ALDH1A1KDM4ETSHRTDP1HPGD | |
| Hydrochloric Acid SCHEMBL28599506 | 0.80 | ALDH1A1 (0.62) | ALDH1A1KDM4ETDP1HPGDLCK | |
| SCHEMBL29765241 | 0.80 | LCK (0.73) | ALDH1A1KDM4EHPGDLCKFYN |
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 |