Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.37 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.37 |
| ▸ | GALR3 | O60755 | 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 | |
|---|---|---|---|---|
| SCHEMBL1498219 | 0.98 | TSHR (0.50) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| Bromide SCHEMBL17536050 | 0.95 | TSHR (0.48) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| Hydrochloric Acid SCHEMBL10629539 | 0.95 | THRB (0.50) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| Iodide SCHEMBL21253234 | 0.95 | TSHR (0.48) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| SCHEMBL1262355 | 0.88 | TSHR (0.42) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| Methacrylic Acid SCHEMBL28074139 | 0.88 | THRB (0.44) | TSHRTHRBALDH1A1CHRM5CHRM1 | |
| SCHEMBL11760936 | 0.83 | TSHR (0.39) | TSHRTHRBALDH1A1GALR3POLB | |
| SCHEMBL4937680 | 0.83 | TSHR (0.39) | TSHRTHRBALDH1A1GALR3 | |
| SCHEMBL5145800 | 0.80 | THRB (0.42) | TSHRTHRBALDH1A1 | |
| SCHEMBL671829 | 0.78 | THRB (0.47) | TSHRTHRBALDH1A1CHRM5CHRM1 |
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-105567260-A | Print Functionalized photoreactive compounds | ROLIC AG | 2016-05-11 | — | — | CN | disclosed |
| CN-101268168-B | Functionalized photoreactive compounds | ROLIC AG (CH) | 2016-01-20 | — | — | CN | disclosed |