Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.38 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30126132 | 0.89 | CYP17A1 (0.40) | CYP17A1ATRKCNQ4KCNQ5NPC1 | |
| SCHEMBL24427976 | 0.87 | CYP17A1 (0.42) | CYP17A1KCNQ4KCNQ5NPC1RAB9A | |
| SCHEMBL30038713 | 0.84 | CYP17A1 (0.40) | CYP17A1ATRKCNQ4KCNQ5NPC1 | |
| SCHEMBL28459659 | 0.84 | CYP17A1 (0.40) | CYP17A1ATRKCNQ4KCNQ5NPC1 | |
| SCHEMBL28458867 | 0.83 | KCNQ3 (0.41) | CYP17A1KCNQ4KCNQ5NPC1RAB9A | |
| SCHEMBL34473354 | 0.82 | ATR (0.40) | CYP17A1ATRNPC1RAB9AMEN1 | |
| SCHEMBL21468506 | 0.82 | KCNQ4 (0.40) | CYP17A1ATRKCNQ4KCNQ5NPC1 | |
| SCHEMBL3288639 | 0.81 | CYP17A1 (0.44) | CYP17A1ATRKCNQ4KCNQ5RXFP1 | |
| SCHEMBL22684078 | 0.81 | CYP17A1 (0.38) | CYP17A1KCNQ4KCNQ5NPC1RAB9A | |
| SCHEMBL24427983 | 0.80 | KCNQ4 (0.38) | CYP17A1ATRKCNQ4KCNQ5NPC1 |
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-3998263-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | Shanghai Jemincare Pharmaceuticals Co., Ltd. (CN) | 2022-05-18 | — | — | EP | disclosed |