Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27019949 | 0.70 | POLB (0.41) | POLBGAAALDH1A1MAPTALOX15 | |
| SCHEMBL18700849 | 0.67 | MAPT (0.34) | GAAALDH1A1MAPTALOX15HSD17B10 | |
| SCHEMBL18700848 | 0.67 | MAPT (0.34) | GAAALDH1A1MAPTALOX15HSD17B10 | |
| SCHEMBL29017100 | 0.66 | MEN1 (0.52) | GAAALDH1A1MAPTLMNACYP2C19 | |
| SCHEMBL22057713 | 0.64 | SMN1; SMN2 (0.39) | POLBGAAALDH1A1MAPTALOX15 | |
| SCHEMBL6837455 | 0.64 | SMN1; SMN2 (0.39) | POLBGAAALDH1A1MAPTALOX15 | |
| SCHEMBL441223 | 0.64 | — | — | |
| SCHEMBL1937007 | 0.64 | — | — | |
| SCHEMBL10210465 | 0.64 | — | — | |
| SCHEMBL23609327 | 0.63 | GAA (0.39) | POLBGAAALDH1A1MAPTALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021134004-A1 | CYCLIC COMPOUNDS AND METHODS OF USING SAME | SCHRODINGER, INC. (US) | 2021-07-01 | — | — | WO | disclosed |