Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18436080 | 1.00 | CYP3A4 (0.49) | CYP3A4CYP2C19MEN1KMT2AMAPK1 | |
| SCHEMBL21336928 | 0.86 | CYP3A4 (0.41) | CYP3A4CYP2C19MEN1KMT2AMAPK1 | |
| SCHEMBL18436107 | 0.86 | L3MBTL1 (0.41) | MEN1KMT2AMAPK1TSHRALDH1A1 | |
| SCHEMBL18436332 | 0.86 | L3MBTL1 (0.41) | MEN1KMT2AMAPK1TSHRALDH1A1 | |
| SCHEMBL19012516 | 0.86 | L3MBTL1 (0.41) | MEN1KMT2AMAPK1TSHRALDH1A1 | |
| SCHEMBL21336929 | 0.84 | HTR2C (0.49) | TSHRFAAHALDH1A1HTR2CMAPT | |
| SCHEMBL21336572 | 0.84 | L3MBTL1 (0.40) | CYP3A4CYP2C19MEN1KMT2AMAPK1 | |
| SCHEMBL18436501 | 0.84 | FAAH (0.38) | CYP3A4CYP2C19MEN1KMT2AMAPK1 | |
| SCHEMBL21336726 | 0.83 | GPR119 (0.56) | FAAHALDH1A1MAPTGPR119ABCB1 | |
| SCHEMBL18436059 | 0.83 | NR1H2 (0.42) | CYP3A4CYP2C19MEN1KMT2AMAPK1 |
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 |