Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29046742 | 0.91 | CHRM1 (0.46) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| SCHEMBL8743001 | 0.80 | HDAC1 (0.50) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| SCHEMBL9575274 | 0.78 | — | — | |
| SCHEMBL4790077 | 0.78 | — | — | |
| Acrylic Acid SCHEMBL30912758 | 0.78 | CHRM1 (0.48) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| SCHEMBL1056648 | 0.78 | — | — | |
| SCHEMBL25285567 | 0.78 | CA2 (0.47) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| SCHEMBL3638765 | 0.76 | CHRM1 (0.46) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| SCHEMBL1890045 | 0.75 | TSHR (0.40) | TSHRALDH1A1CHRM1AKR1A1CHRM3 | |
| Acrylamide SCHEMBL28190600 | 0.75 | TSHR (0.48) | TSHRALDH1A1CHRM1AKR1A1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1051454-A1 | LIQUID-CRYSTALLINE PHOTOCROSSLINKABLE MIXTURE | Rolic AG (CH) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999037735-A1 | LIQUID-CRYSTALLINE PHOTOCROSSLINKABLE MIXTURE | ROLIC AG (CH) | 1999-07-29 | — | — | WO | disclosed |