Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.48 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.48 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.48 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.48 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.48 |
| ▸ | GALR3 | O60755 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1365911 | 0.97 | — | — | |
| Isopropyl Alcohol SCHEMBL28973856 | 0.87 | ALDH1A1 (0.44) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| Trimethylammonium SCHEMBL3386942 | 0.87 | ALDH1A1 (0.44) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| SCHEMBL40400 | 0.82 | ALDH1A1 (0.60) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| Ammonia Solution, Strong SCHEMBL5679172 | 0.82 | ALDH1A1 (0.65) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| SCHEMBL10402309 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL9617224 | 0.79 | ALDH1A1 (0.62) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| Ammonia Solution, Strong SCHEMBL829814 | 0.79 | ALDH1A1 (0.62) | ALDH1A1CHRM5CHRM1CHRM3TSHR | |
| SCHEMBL16393970 | 0.79 | — | — | |
| SCHEMBL64593 | 0.78 | ALDH1A1 (0.68) | ALDH1A1CHRM5CHRM1CHRM3TSHR |
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-0359464-B1 | Heat resistant polyvinyl chloride copolymer and preparation process of the copolymer | MITSUI TOATSU CHEMICALS (JP) | 1994-07-20 | — | — | EP | disclosed |
| US-5166271-A | N-substituted maleimide with vinyl chloride graft polymerized | MITSUI TOATSU CHEMICALS, INC. (JP) | 1992-11-24 | — | — | US | disclosed |
| EP-0359464-A2 | Heat resistant polyvinyl chloride copolymer and preparation process of the copolymer | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-03-21 | — | — | EP | disclosed |