Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21164341 | 0.84 | HPGD (0.42) | MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL4311511 | 0.80 | MCL1 (0.47) | PIK3CDMEN1KMT2ANAAA | |
| SCHEMBL20613635 | 0.79 | NAAA (0.32) | MEN1KMT2AALDH1A1NAAA | |
| SCHEMBL12335208 | 0.79 | MEN1 (0.35) | MEN1KMT2AALDH1A1NAAA | |
| SCHEMBL26731302 | 0.78 | PIK3CD (0.44) | PIK3CDMEN1KMT2AALDH1A1HMGCR | |
| SCHEMBL22225194 | 0.75 | PIK3CD (0.50) | PIK3CDMEN1KMT2AALDH1A1HPGD | |
| SCHEMBL9433171 | 0.75 | CASP2 (0.57) | MEN1KMT2AALDH1A1NAAA | |
| SCHEMBL13627870 | 0.75 | ALDH1A1 (0.52) | PIK3CDMEN1KMT2AALDH1A1HPGD | |
| SCHEMBL12308816 | 0.75 | ALDH1A1 (0.36) | PIK3CDALDH1A1 | |
| SCHEMBL21516603 | 0.75 | PIK3CD (0.48) | PIK3CDMEN1KMT2AALDH1A1HMGCR |
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-3124482-B1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) | 2019-09-11 | — | — | EP | disclosed |
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |