Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 9/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27882963 | 0.98 | MAPT (0.39) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL4632793 | 0.79 | TSHR (0.41) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL2946080 | 0.77 | TSHR (0.59) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL28095366 | 0.76 | TSHR (0.40) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL10994965 | 0.76 | TSHR (0.40) | TSHRSMN1; SMN2HPGDALDH1A1TP53 | |
| SCHEMBL4899694 | 0.76 | TSHR (0.38) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| Hydrochloric Acid SCHEMBL1238012 | 0.76 | MAPT (0.60) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| Bromide SCHEMBL28073958 | 0.76 | TSHR (0.57) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| SCHEMBL8191490 | 0.76 | TSHR (0.38) | TSHRCHRM2CHRM4CHRM1TBXA2R | |
| Hydrochloric Acid SCHEMBL27770233 | 0.75 | MAPT (0.42) | TSHRCHRM2CHRM4CHRM1TBXA2R |
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-1725671-B1 | BIOCATALYTIC MANUFACTURING OF (METH)ACRYLYLCHOLINE OR 2-(N,N-DIMETHYLAMINO)ETHYL (METH)ACRYLATE | CIBA SPEC CHEM WATER TREAT LTD (GB) | 2009-12-09 | — | — | EP | claimed |
| EP-1725671-A1 | BIOCATALYTIC MANUFACTURING OF (METH)ACRYLYLCHOLINE OR 2-(N,N-DIMETHYLAMINO)ETHYL (METH)ACRYLATE | Ciba Specialty Chemicals Water Treatments Limited (GB) | 2006-11-29 | — | — | EP | disclosed |
| WO-2005090586-A1 | BIOCATALYTIC MANUFACTURING OF (METH)ACRYLYLCHOLINE OR 2-(N,N-DIMETHYLAMINO)ETHYL (METH)ACRYLATE | CIBA SPECIALTY CHEMICALS WATER TREATMENTS LIMITED (GB) | 2005-09-29 | — | — | WO | disclosed |