Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 4/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21336716 | 1.00 | HSD11B1 (0.39) | HSD11B1ACACBCHRM1HCAR2WNT3A | |
| SCHEMBL18436829 | 0.83 | PDE10A (0.41) | HSD11B1ACACBCHRM1HCAR2CHRM2 | |
| SCHEMBL18436007 | 0.83 | PDE10A (0.41) | HSD11B1ACACBCHRM1HCAR2CHRM2 | |
| SCHEMBL18436431 | 0.82 | CHRM1 (0.40) | HSD11B1ACACBCHRM1HCAR2GRM1 | |
| SCHEMBL17128141 | 0.82 | HSD11B1 (0.45) | HSD11B1ACACBCHRM1HCAR2GRM1 | |
| SCHEMBL21336857 | 0.82 | HSD11B1 (0.40) | HSD11B1ACACBCHRM1HCAR2GRM1 | |
| SCHEMBL17128148 | 0.81 | HSD11B1 (0.42) | HSD11B1CHRM1HCAR2MAPTKDM4E | |
| SCHEMBL17128146 | 0.81 | RAB9A (0.52) | HSD11B1ACACBMAPTKDM4ERAB9A | |
| SCHEMBL19012473 | 0.80 | ACACB (0.48) | HSD11B1ACACBCHRM1 | |
| SCHEMBL18436191 | 0.80 | HSD11B1 (0.39) | HSD11B1ACACBCHRM1HCAR2GRM1 |
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-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |