Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.62 |
| ▸ | MAPT | P10636 | 6/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | FDPS | P14324 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2559995 | 0.95 | ALDH1A1 (0.55) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29955622 | 0.89 | TACR2 (0.55) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29951459 | 0.87 | ALDH1A1 (0.44) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29952525 | 0.83 | ALDH1A1 (0.41) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29952934 | 0.81 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL15330601 | 0.79 | ALDH1A1 (0.44) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29957022 | 0.79 | ALDH1A1 (0.50) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL2556665 | 0.79 | RAB9A (0.45) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL2557419 | 0.78 | ALDH1A1 (0.62) | ALDH1A1MAPTSMN1; SMN2HTTNPC1 | |
| SCHEMBL29953910 | 0.76 | ALDH1A1 (0.44) | ALDH1A1MAPTSMN1; SMN2RAB9AMEN1 |
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 |