Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.68 |
| ▸ | HPGD | P15428 | 3/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.68 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.68 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.68 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.68 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.68 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.68 |
| ▸ | CALCRL | Q16602 | 6/20 | 0.61 |
| ▸ | SCN1A | P35498 | 1/20 | 0.56 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9466659 | 0.96 | MAPT (0.72) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL9487633 | 0.92 | CYP2D6 (0.72) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8198028 | 0.92 | MAPT (0.82) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL15906048 | 0.92 | MAPT (0.82) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5892722 | 0.92 | MAPT (0.82) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL16234445 | 0.92 | MAPT (0.82) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL9487218 | 0.89 | CYP2D6 (0.74) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL25307727 | 0.88 | CYP2D6 (0.71) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL336344 | 0.88 | CYP2D6 (0.71) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 | |
| SCHEMBL1955402 | 0.88 | CYP2D6 (0.71) | MAPTCYP2D6KDM4EALDH1A1HSD17B10 |
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-0526582-A1 | HETEROCYCLIC CHIRAL LIGANDS AND METHOD FOR CATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1993-02-10 | — | — | EP | claimed |
| WO-1991016322-A2 | HETEROCYCLIC CHIRAL LIGANDS AND METHOD FOR CATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1991-10-31 | — | — | WO | claimed |