Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15330183 | 0.86 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2LMNAMAPTHPGD | |
| SCHEMBL29952731 | 0.82 | MAOA (0.41) | ALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL11047959 | 0.78 | HSP90AB1 (0.47) | ALDH1A1LMNA | |
| SCHEMBL28216766 | 0.78 | ESR1 (0.48) | ABAT | |
| SCHEMBL28260270 | 0.78 | HTR2C (0.40) | ALDH1A1LMNAMAPTHPGD | |
| SCHEMBL11050091 | 0.78 | LPL (0.36) | ALDH1A1SMN1; SMN2LMNAMAPTHPGD | |
| SCHEMBL6971279 | 0.78 | HRH3 (0.38) | ABAT | |
| SCHEMBL6972732 | 0.78 | NOTUM (0.39) | ALDH1A1RAB9ACYP2A6 | |
| SCHEMBL3149298 | 0.78 | L3MBTL1 (0.49) | ALDH1A1SMN1; SMN2LMNAMAPTRAB9A | |
| SCHEMBL649075 | 0.77 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNARAB9AMEN1 |
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 |