Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7770049 | 0.97 | LCK (0.46) | LCKTSHRALDH1A1 | |
| SCHEMBL817850 | 0.97 | LCK (0.46) | LCKTSHRALDH1A1 | |
| SCHEMBL28508921 | 0.92 | LCK (0.43) | LCKTSHRALDH1A1 | |
| SCHEMBL714583 | 0.90 | LCK (0.41) | LCKTSHRALDH1A1 | |
| SCHEMBL11040899 | 0.89 | LCK (0.44) | LCKTSHRALDH1A1 | |
| SCHEMBL8087294 | 0.86 | LCK (0.43) | LCKTSHRALDH1A1 | |
| SCHEMBL62798 | 0.86 | TSHR (0.39) | LCKTSHRALDH1A1 | |
| SCHEMBL64887 | 0.86 | TSHR (0.39) | LCKTSHRALDH1A1 | |
| SCHEMBL8763482 | 0.85 | TSHR (0.41) | TSHRALDH1A1 | |
| SCHEMBL159040 | 0.85 | TSHR (0.41) | TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6028193-A | CATALYZING THE OXIDATION REACTION IN PRESENCE OF A TRANSITION METAL COMPLEX WHICH CONTAINS A CYCLIC POLYFUNCTIONAL AMINE COMPOUND HAVING AT LEAST THREE NITROGEN ATOMS IN THE RING FORMING MOLECULAR | MITSUI CHEMICALS, INC. (JP) | 2000-02-22 | — | — | US | disclosed |