Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1890967 | 1.00 | ALDH1A1 (0.61) | ALDH1A1TTRTSHRMEN1KMT2A | |
| Tetrahydrofuran SCHEMBL2360611 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHRMEN1KMT2A | |
| SCHEMBL9539378 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHRMEN1KMT2A | |
| SCHEMBL9050010 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHR | |
| SCHEMBL7758217 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHRMEN1KMT2A | |
| Tetrahydrofuran SCHEMBL23573614 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHRMEN1KMT2A | |
| SCHEMBL11741977 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHR | |
| Dioxane SCHEMBL5598923 | 0.96 | ALDH1A1 (0.67) | ALDH1A1TTRTSHRMEN1KMT2A | |
| SCHEMBL3419841 | 0.92 | ALDH1A1 (0.61) | ALDH1A1TTRTSHR | |
| SCHEMBL1080336 | 0.92 | — | — |
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-2621923-B1 | N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES | INTERVET INT BV (NL) | 2017-03-29 | — | — | EP | claimed |
| US-5778515-A | METHOD OF PREPARING AN ELECTRODE/SEPARATOR ASSEMBLY | VALENCE TECHNOLOGY, INC. (US) | 1998-07-14 | — | — | US | disclosed |