Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21336665 | 0.82 | KMT2A (0.48) | HDAC1HDAC2HDAC3CYP2C9SLC6A4 | |
| SCHEMBL12542345 | 0.78 | SGPL1 (0.54) | HDAC1HDAC2HDAC3CYP2C9SLC6A4 | |
| SCHEMBL23183064 | 0.76 | KMT2A (0.57) | HDAC1SLC6A3KMT2AMEN1RAB9A | |
| SCHEMBL18436101 | 0.76 | HSD11B1 (0.43) | — | |
| SCHEMBL18436778 | 0.76 | HSD11B1 (0.43) | — | |
| SCHEMBL18436960 | 0.75 | HSD11B1 (0.42) | HDAC1 | |
| SCHEMBL8241566 | 0.74 | HDAC1 (0.72) | HDAC1HDAC2HDAC3CYP2C9SLC6A4 | |
| SCHEMBL19581104 | 0.74 | KMT2A (0.55) | HDAC1HDAC2HDAC3CYP2C9SLC6A4 | |
| SCHEMBL17128146 | 0.74 | RAB9A (0.52) | HDAC1SGPL1KMT2ARAB9ANPC1 | |
| SCHEMBL19580906 | 0.74 | KMT2A (0.52) | HDAC1HDAC2HDAC3CYP2C9SLC6A4 |
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-B1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) | 2019-09-11 | — | — | EP | disclosed |