Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | XPO1 | O14980 | 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 | |
|---|---|---|---|---|
| SCHEMBL28630081 | 0.85 | DGAT1 (0.45) | KMT2ANPC1RAB9ASRD5A2DGAT1 | |
| SCHEMBL28617165 | 0.83 | SCN9A (0.51) | KMT2ANPC1RAB9AMEN1TSHR | |
| SCHEMBL28922176 | 0.80 | HDAC1 (0.46) | KMT2ANPC1RAB9ASRD5A2SIGMAR1 | |
| SCHEMBL28615098 | 0.79 | NR1H3 (0.62) | KMT2ANPC1MEN1EPHX2MAPT | |
| SCHEMBL28624617 | 0.78 | RORC (0.44) | KMT2ANPC1RAB9ASRD5A2RORC | |
| SCHEMBL4902013 | 0.78 | POLB (0.52) | POLBKMT2AMEN1TSHRIDO1 | |
| SCHEMBL16042116 | 0.77 | NOTUM (0.43) | POLBHPGDIDO1KCNH2NR3C2 | |
| SCHEMBL28623383 | 0.76 | KMT2A (0.44) | POLBKMT2ANPC1RAB9AMEN1 | |
| SCHEMBL5015512 | 0.75 | POLB (0.77) | POLBHPGDNR3C2ALDH1A1MAPT | |
| SCHEMBL22895349 | 0.74 | CCNK (0.52) | POLBNPC1RAB9ANR3C2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113121463-A | Amide compound with bicyclic structure and application thereof in medicines | 广东东阳光药业有限公司 | 2021-07-16 | — | — | CN | disclosed |