Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | XPO1 | O14980 | 1/20 | 0.39 |
| ▸ | SSTR5 | P35346 | 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 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28617165 | 0.90 | SCN9A (0.51) | KMT2ASCN9ANPC1RAB9ASRD5A2 | |
| SCHEMBL28629897 | 0.86 | CYP2C9 (0.50) | KMT2ASCN9APIK3CDPIK3CAMEN1 | |
| SCHEMBL28615405 | 0.80 | HDAC1 (0.46) | KMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL28624609 | 0.77 | SCN9A (0.48) | KMT2ASCN9ANPC1RAB9ASRD5A2 | |
| SCHEMBL28626488 | 0.76 | POLB (0.49) | KMT2ANPC1RAB9ASRD5A2PIK3CA | |
| SCHEMBL171164 | 0.73 | TTR (0.49) | SCN9ASRD5A2XPO1SSTR5TEAD1 | |
| SCHEMBL28922176 | 0.73 | HDAC1 (0.46) | KMT2ANPC1RAB9ASRD5A2 | |
| SCHEMBL18344110 | 0.73 | PTGER3 (0.49) | KMT2ANPC1RAB9AMEN1ALDH1A1 | |
| SCHEMBL29364684 | 0.73 | PTGER3 (0.49) | KMT2ANPC1RAB9AMEN1ALDH1A1 | |
| SCHEMBL23619026 | 0.73 | RORC (0.49) | — |
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 |