Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17036928 | 0.99 | THRB (0.55) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL17036924 | 0.96 | THRB (0.61) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL17036930 | 0.94 | THRB (0.56) | THRBTSHRALDH1A1SERPINE1KMT2A | |
| SCHEMBL17033932 | 0.90 | THRB (0.66) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL19456758 | 0.90 | THRB (0.66) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL19456798 | 0.89 | THRB (0.64) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL17033935 | 0.89 | THRB (0.64) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL17034286 | 0.86 | THRB (0.65) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL19456783 | 0.86 | THRB (0.64) | THRBTSHRALDH1A1TP53HIF1A | |
| SCHEMBL19456745 | 0.86 | THRB (0.71) | THRBTSHRALDH1A1TP53HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015126862-A1 | DENTAL COMPOSITION AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-08-27 | — | — | WO | disclosed |