Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | LOX | P28300 | 1/20 | 0.39 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30185665 | 0.86 | — | — | |
| SCHEMBL27233648 | 0.84 | ALDH1A1 (0.73) | ALDH1A1TDP1TSHRLOXLOXL3 | |
| SCHEMBL56391 | 0.78 | — | — | |
| SCHEMBL16037462 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TDP1TSHRLOXLOXL3 | |
| Lithium SCHEMBL29833770 | 0.74 | — | — | |
| SCHEMBL30321467 | 0.74 | — | — | |
| SCHEMBL2683512 | 0.74 | — | — | |
| Lithium SCHEMBL29763173 | 0.74 | — | — | |
| SCHEMBL10010661 | 0.72 | — | — | |
| SCHEMBL19999793 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6686428-B2 | TRANSMETALLATION REAGENTS REACTED WITH ALPHA-HALOCARBONYL COMPOUNDS IN THE PRESENCE OF A METAL CATALYST | THE PENN STATE RESEARCH FOUNDATION | 2004-02-03 | — | — | US | disclosed |
| US-20020193543-A1 | Transmetallation reagents reacted with alpha-halocarbonyl compounds in the presence of a metal catalyst | NATIONAL INSTITUTES OF HEALTH | 2002-12-19 | — | — | US | disclosed |