Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.37 |
| ▸ | TPMT | P51580 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29394151 | 0.88 | TSHR (0.46) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| SCHEMBL124763 | 0.88 | TSHR (0.46) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| SCHEMBL6396616 | 0.86 | TSHR (0.45) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| Butanedione SCHEMBL27926797 | 0.79 | LMNA (0.44) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| Glutarate SCHEMBL11207827 | 0.77 | TSHR (0.49) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| SCHEMBL6012587 | 0.76 | LMNA (0.40) | TSHRMAPK1LMNACYP2C9CHRM1 | |
| SCHEMBL30956331 | 0.75 | MAPK1 (0.42) | TSHRMAPK1ALDH1A1TPMT | |
| SCHEMBL29248751 | 0.75 | MAPK1 (0.42) | TSHRMAPK1ALDH1A1TPMT | |
| SCHEMBL8663431 | 0.74 | LMNA (0.33) | LMNACYP2C9CHRM1TBXA2RPDE4A | |
| SCHEMBL377395 | 0.73 | MAPK1 (0.53) | TSHRMAPK1LMNACYP2C9CHRM1 |
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-5780668-A | A CURABLE MONOMER OF A (MONO-, DI- OR TRIACRYLOYLOXY-SUBSTITUTED ALKYLENEAMIDO OR OXYCARBONYL-) -TRIODOBENZENES; REPLACES FILLERS IN CROWNS, BRIDGES ETC.; UV RESISTANCE; STABILITY | IVOCLAR AG (LI) | 1998-07-14 | — | — | US | disclosed |