Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 12/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 12/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 11/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL2796363 | 0.99 | HTT (0.45) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL3676930 | 0.99 | HTT (0.45) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL3679014 | 0.97 | HTT (0.45) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2794178 | 0.97 | HTT (0.45) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2795785 | 0.95 | HTT (0.42) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2797746 | 0.95 | HTT (0.46) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2794159 | 0.95 | HTT (0.42) | HTTCHRM2CHRM1CHRM3 | |
| Bromide SCHEMBL2792719 | 0.95 | HTT (0.46) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2792073 | 0.93 | HTT (0.42) | HTTALDH1A1CHRM2CHRM1SLC6A3 | |
| Bromide SCHEMBL2792277 | 0.92 | HTT (0.43) | HTTCHRM2CHRM1CHRM3 |
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-2111861-A1 | Compositions of phosphodiesterase type IV inhibitors | Ranbaxy Laboratories Limited (IN) | 2009-10-28 | — | — | EP | claimed |
| EP-2111861-A1 | Compositions of phosphodiesterase type IV inhibitors | Ranbaxy Laboratories Limited (IN) | 2009-10-28 | — | — | EP | disclosed |