Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | IKBKB | O14920 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8200565 | 1.00 | NAMPT (0.51) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL8914912 | 0.89 | NAMPT (0.56) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL504863 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL504982 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| Chs-828 SCHEMBL504892 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL505054 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| Chs-828 SCHEMBL504151 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL504983 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL504997 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL504126 | 0.86 | NAMPT (0.61) | NAMPTCYP3A4CYP2D6CYP2C19CYP2C9 |
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-2000061561-A1 | CYANOGUANIDINE COMPOUNDS | SHIONOGI BIORESEARCH CORP. (US) | 2000-10-19 | — | — | WO | disclosed |