Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL59695 | 0.98 | TSHR (0.42) | TSHRTHRBALDH1A1 | |
| SCHEMBL2470350 | 0.94 | ALDH1A1 (0.46) | TSHRTHRBALDH1A1 | |
| SCHEMBL27680542 | 0.89 | TSHR (0.47) | TSHRTHRBALDH1A1 | |
| SCHEMBL27660519 | 0.88 | TSHR (0.50) | TSHRTHRBALDH1A1 | |
| SCHEMBL29154616 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 | |
| SCHEMBL16754226 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 | |
| SCHEMBL29154618 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 | |
| SCHEMBL27871186 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 | |
| SCHEMBL26648800 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 | |
| SCHEMBL27710015 | 0.86 | TSHR (0.53) | TSHRTHRBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103665729-B | Oil-extended styrene-butadiene rubber containing nano silicon dioxide on surface, composition and preparation method thereof | PETROCHINA COMPANY LIMITED (CN) | 2016-05-11 | — | — | CN | disclosed |
| US-4443197-A | ANTICARIES, DRILLING, ACID ETCHING, FILLING | KURARAY CO., LTD. (JP) | 1984-04-17 | — | — | US | disclosed |