Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 8/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | XPO1 | O14980 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.39 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.39 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.39 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL28623383 | 0.90 | KMT2A (0.44) | SCN9AKMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL28624609 | 0.86 | SCN9A (0.48) | SCN9AKMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL28626488 | 0.83 | POLB (0.49) | KMT2ANPC1RAB9ASRD5A2XPO1 | |
| SCHEMBL28922176 | 0.80 | HDAC1 (0.46) | KMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL24100124 | 0.80 | USP30 (0.49) | SCN9AKMT2ANPC1RAB9AMEN1 | |
| SCHEMBL23618981 | 0.80 | SCN9A (0.47) | SCN9AALDH1A1SCN5A | |
| SCHEMBL28615098 | 0.79 | NR1H3 (0.62) | KMT2ANPC1MEN1MAPTNR1H3 | |
| SCHEMBL28624617 | 0.78 | RORC (0.44) | KMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL28630081 | 0.78 | DGAT1 (0.45) | KMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL22226990 | 0.78 | HPGD (0.56) | ALDH1A1MAPTTSHR |
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 |