Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | GRM8 | O00222 | 1/20 | 0.46 |
| ▸ | GRM6 | O15303 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.39 |
| ▸ | HPGD | P15428 | 7/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28458329 | 0.82 | CA2 (0.54) | HSD17B10KDM4ESMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL15754098 | 0.81 | ACHE (0.44) | HSD17B10KMT2ATDP1MEN1CYP2C9 | |
| SCHEMBL149826 | 0.79 | KDM4E (0.49) | HSD17B10KMT2ATDP1MEN1CYP2C9 | |
| SCHEMBL148325 | 0.79 | SIRT6 (0.47) | KMT2ATDP1MEN1KDM4ESMN1; SMN2 | |
| SCHEMBL8908076 | 0.79 | HSD17B10 (0.46) | HSD17B10KMT2ATDP1MEN1CYP2C9 | |
| SCHEMBL19066300 | 0.77 | ALDH1A1 (0.43) | HSD17B10KMT2ATDP1MEN1CYP2C9 | |
| SCHEMBL9269600 | 0.76 | HSD17B10 (0.47) | HSD17B10KMT2ATDP1MEN1CYP2C9 | |
| SCHEMBL3508966 | 0.74 | KDM4E (0.40) | HSD17B10TDP1KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL11575404 | 0.72 | POLB (0.55) | HSD17B10KMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL9269604 | 0.72 | HSD17B10 (0.46) | HSD17B10KMT2ATDP1MEN1CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2205596-A1 | (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING | COMENTIS, INC. (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009042694-A1 | (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING | COMENTIS, INC. (US) | 2009-04-02 | — | — | WO | disclosed |