Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.53 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.53 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 3/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL8820576 | 0.92 | TSHR (0.91) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL21295161 | 0.90 | TSHR (0.72) | TSHRALDH1A1CYP3A4CA2LMNA | |
| Phthalic Acid SCHEMBL28001687 | 0.90 | TSHR (0.72) | TSHRALDH1A1CYP3A4CA2LMNA | |
| Styrene SCHEMBL491218 | 0.90 | TSHR (0.72) | TSHRALDH1A1CYP3A4CA2LMNA | |
| Benzene SCHEMBL8735839 | 0.89 | TSHR (0.85) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL31365383 | 0.89 | TSHR (0.71) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL8656081 | 0.88 | TSHR (0.74) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL4254222 | 0.88 | TSHR (0.69) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL20609794 | 0.87 | TSHR (1.00) | TSHRALDH1A1CYP3A4CA2LMNA | |
| SCHEMBL14869 | 0.87 | TSHR (1.00) | TSHRALDH1A1CYP3A4CA2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102471526-A | Polymers comprising heterocyclic 3-membered ring compounds and iodine-containing compounds | LANXESS DEUTSCHLAND GMBH | 2012-05-23 | — | — | CN | disclosed |