Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | KIT | P10721 | 2/20 | 0.34 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.34 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | CBLB | Q13191 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | SCD | O00767 | 1/20 | 0.31 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22979593 | 1.00 | NPC1 (0.35) | NPC1RAB9AKITPCSK9DDR1 | |
| SCHEMBL22996558 | 0.84 | PCSK9 (0.48) | PCSK9MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL22996562 | 0.78 | KMT2A (0.35) | KMT2ATAAR1 | |
| SCHEMBL22979871 | 0.76 | KCNN3 (0.36) | NPC1RAB9ACBLBKCNN3ALDH1A1 | |
| SCHEMBL22979868 | 0.76 | KCNN3 (0.36) | NPC1RAB9ACBLBKCNN3ALDH1A1 | |
| SCHEMBL18422575 | 0.68 | LMNA (0.50) | NPC1RAB9AESR1KCNH2LMNA | |
| SCHEMBL22978874 | 0.68 | PDE10A (0.32) | KMT2AKCNN3 | |
| SCHEMBL22996432 | 0.66 | SIRT2 (0.31) | — | |
| SCHEMBL24253457 | 0.64 | GABRA1 (0.35) | KITPCSK9DDR1ESR1KCNN3 | |
| SCHEMBL4333892 | 0.63 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2AESR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021027503-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND INTERMEDIATE AND USE THEREOF | 罗欣药业(上海)有限公司 | 2021-02-18 | — | — | WO | disclosed |