Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL208902 | 1.00 | TSHR (0.43) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| Toluene SCHEMBL18394200 | 0.91 | LMNA (0.48) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| SCHEMBL17442483 | 0.86 | ESR1 (0.39) | HIF1AALDH1A1TRPA1 | |
| SCHEMBL6671378 | 0.84 | TSHR (0.43) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| SCHEMBL7769306 | 0.84 | TSHR (0.43) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| SCHEMBL3799465 | 0.82 | ADRA2A (0.43) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| SCHEMBL7765413 | 0.78 | TSHR (0.39) | TSHRAOC3TAAR1ADRA2AADRA2C | |
| SCHEMBL5484844 | 0.77 | ADRB2 (0.52) | TSHRAOC3LMNAHIF1A | |
| SCHEMBL839864 | 0.77 | CHRNA7 (0.41) | LMNAALDH1A1TRPA1 | |
| SCHEMBL9644426 | 0.77 | CYP3A4 (0.44) | TSHRCYP2D6LMNAALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0731105-B1 | Optically active tertiary phosphine compounds, transition metal complexes comprising the same as ligands and process for preparing optically active organic silicon compounds using said transition metal complexes | SUMITOMO CHEMICAL CO (JP) | 2001-12-05 | — | — | EP | disclosed |
| US-5621129-A | Optically active tertiary phosphine compound, transition metal complex comprising the same as ligand and process for preparing optically active organic silicon compound using said transition metal complex | SUMITOMO CHEMICAL CO., LTD. (JP) | 1997-04-15 | — | — | US | disclosed |
| EP-0731105-A1 | Optically active tertiary phosphine compounds, transition metal complexes comprising the same as ligands and process for preparing optically active organic silicon compounds using said transition metal complexes | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-09-11 | — | — | EP | disclosed |