Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 3/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31037355 | 0.81 | NAMPT (0.48) | IKBKBNAMPTBRAFAPPCYP1A2 | |
| SCHEMBL31037307 | 0.77 | NAMPT (0.47) | IKBKBNAMPTCACNA1GMEN1KMT2A | |
| SCHEMBL31037320 | 0.77 | MAPT (0.47) | IKBKBNAMPTBRAFCYP1A2CYP2D6 | |
| SCHEMBL3642214 | 0.72 | CYP1A2 (0.65) | CACNA1GMEN1KMT2ADRD2DRD4 | |
| SCHEMBL31037481 | 0.72 | NAMPT (0.53) | NAMPTCACNA1GBRAF | |
| SCHEMBL31037343 | 0.72 | NAMPT (0.53) | NAMPTCACNA1GBRAF | |
| SCHEMBL29605727 | 0.69 | CYP1A2 (0.74) | NAMPTMEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL31037368 | 0.69 | MAPK14 (0.47) | NAMPTDRD2DRD4DRD3 | |
| SCHEMBL30969330 | 0.68 | ALDH1A1 (0.71) | MEN1KMT2ACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4502913 | 0.67 | CYP1A2 (0.73) | MEN1KMT2AAPPCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024166024-A1 | NEW COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 삼진제약주식회사 | 2024-08-15 | — | — | WO | disclosed |