Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 9/20 | 0.41 |
| ▸ | WNT3A | P56704 | 9/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11828403 | 0.82 | PTPN1 (0.50) | CTNNB1WNT3ATDP1ALDH1A1TSHR | |
| SCHEMBL11297486 | 0.77 | ALDH1A1 (0.43) | CTNNB1WNT3ATDP1ALDH1A1TSHR | |
| SCHEMBL12251425 | 0.77 | ALDH1A1 (0.50) | TDP1ALDH1A1HDAC8L3MBTL1MAPT | |
| SCHEMBL1148444 | 0.76 | ALDH1A1 (0.50) | TDP1ALDH1A1TSHRALOX5PTGS1 | |
| SCHEMBL6241330 | 0.75 | CYP19A1 (0.54) | CTNNB1TDP1ALDH1A1TSHRDRD2 | |
| SCHEMBL1505336 | 0.75 | ALDH1A1 (0.42) | CTNNB1WNT3ATDP1ALDH1A1TSHR | |
| SCHEMBL10767524 | 0.75 | DRD2 (0.55) | CHRM1CHRM2CHRM4HTR1ACHRM5 | |
| SCHEMBL30663932 | 0.74 | ALDH1A1 (0.48) | TDP1ALDH1A1TSHRALOX5PTGS1 | |
| SCHEMBL28522369 | 0.73 | GABRA1 (0.44) | CTNNB1WNT3ATDP1ALDH1A1TSHR | |
| SCHEMBL27100051 | 0.72 | ALDH1A1 (0.41) | CTNNB1WNT3ATDP1ALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0292735-B1 | PROCESS FOR PREPARING ALPHA-(ALKYLPHENYL)-4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINE BUTANOL | ERREGIERRE INDUSTRIA CHIMICA Spa (IT) | 1992-08-19 | — | — | EP | disclosed |