Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NOS3 | P29474 | 5/20 | 0.39 |
| ▸ | NOS2 | P35228 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LOX | P28300 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL30050747 | 1.00 | HTT (0.47) | HTTHSD17B10NOS3NOS2TSHR | |
| SCHEMBL28257885 | 0.78 | NOS2 (0.46) | HTTHSD17B10NOS3NOS2TSHR | |
| SCHEMBL157196 | 0.78 | HTT (0.50) | HTTHSD17B10NOS3NOS2POLB | |
| SCHEMBL22304455 | 0.78 | NOS3 (0.38) | HTTHSD17B10NOS3NOS2TSHR | |
| SCHEMBL23074936 | 0.77 | TRPV4 (0.34) | HTTHSD17B10NOS3NOS2TSHR | |
| Ammonia Solution, Strong SCHEMBL28593822 | 0.77 | NOS3 (0.45) | HTTHSD17B10NOS3NOS2TSHR | |
| SCHEMBL16127584 | 0.77 | HTT (0.34) | HTTHSD17B10NOS3NOS2TSHR | |
| SCHEMBL16992858 | 0.77 | HTT (0.49) | HTTHSD17B10NOS3NOS2POLB | |
| Hydrochloric Acid SCHEMBL16992973 | 0.75 | HTT (0.47) | HTTHSD17B10NOS3NOS2POLB | |
| SCHEMBL21598467 | 0.75 | HTT (0.47) | HTTHSD17B10NOS3NOS2POLB |
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-116348453-A | Heteroaromatic carboxamide compounds and uses thereof | 烨辉医药科技(上海)有限公司 | 2023-06-27 | — | — | CN | disclosed |