Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.34 |
| ▸ | FDPS | P14324 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | FNTA | P49354 | 1/20 | 0.31 |
| ▸ | FNTB | P49356 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11557290 | 1.00 | ALOX15 (0.46) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL18735985 | 0.82 | ALOX15 (0.56) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL12446349 | 0.82 | ALOX15 (0.56) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL18736150 | 0.82 | ALOX15 (0.56) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL11549050 | 0.81 | PTPN1 (0.37) | ALOX15ALDH1A1TSHR | |
| SCHEMBL11550798 | 0.81 | PTPN1 (0.37) | ALOX15ALDH1A1TSHR | |
| SCHEMBL11069548 | 0.78 | ALOX15 (0.48) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL11069526 | 0.78 | ALOX15 (0.48) | ALOX15ALDH1A1USP2GGPS1FDPS | |
| SCHEMBL11549705 | 0.78 | MGAM (0.39) | ALOX15ALDH1A1TSHR | |
| SCHEMBL7700795 | 0.77 | ALOX15 (0.50) | ALOX15ALDH1A1USP2NFE2L2CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4160865-A | Asymmetric synthesis | HOFFMANN-LA ROCHE INC. (US) | 1979-07-10 | — | — | US | disclosed |
| US-4151360-A | Optically active amine salts | HOFFMANN-LA ROCHE INC. (US) | 1979-04-24 | — | — | US | disclosed |
| US-4102909-A | Optically active esters and amides | HOFFMANN-LA ROCHE INC. (US) | 1978-07-25 | — | — | US | disclosed |
| US-4094892-A | CLAISEN REARRANGEMENT | HOFFMANN-LA ROCHE INC. (US) | 1978-06-13 | — | — | US | disclosed |
| US-4045475-A | Optically active alcohols and lower esters thereof | HOFFMANN-LA ROCHE INC. (US) | 1977-08-30 | — | — | US | disclosed |