Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 8/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 7/20 | 0.45 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL15059508 | 1.00 | GPR119 (0.45) | GPR119NOTUMKCNMA1HDAC8GABRA1 | |
| SCHEMBL16753150 | 0.86 | NOTUM (0.56) | NOTUMKCNMA1HDAC8GABRA2 | |
| SCHEMBL31234511 | 0.86 | NOTUM (0.56) | NOTUMKCNMA1HDAC8GABRA2 | |
| SCHEMBL30994998 | 0.81 | NOTUM (0.52) | NOTUMKCNMA1HDAC8GABRA2 | |
| SCHEMBL16753902 | 0.81 | NOTUM (0.52) | NOTUMKCNMA1HDAC8GABRA2 | |
| SCHEMBL16754018 | 0.80 | NOTUM (0.53) | NOTUMKCNMA1HDAC8 | |
| SCHEMBL30995043 | 0.80 | NOTUM (0.53) | NOTUMKCNMA1HDAC8 | |
| SCHEMBL24624555 | 0.78 | GPR119 (0.40) | GPR119NOTUMKCNMA1GABRA1GABRG2 | |
| SCHEMBL29772920 | 0.78 | GPR119 (0.40) | GPR119NOTUMKCNMA1GABRA1GABRG2 | |
| SCHEMBL31123904 | 0.77 | NOTUM (0.41) | GPR119NOTUM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118894814-A | Preparation method of 1- (2-bromo-4-chlorophenyl) -4- (trifluoromethyl) -1H-1,2, 3-triazole | 上海康鹏科技股份有限公司 | 2024-11-05 | — | — | CN | disclosed |
| CN-118126046-A | Substituted macrocyclic compound, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-06-04 | — | — | CN | disclosed |