Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.46 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.43 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.35 |
| ▸ | TYK2 | P29597 | 2/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.35 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20470731 | 0.74 | CYP2D6 (0.46) | NUDT1KDM4DCHEK1ALDH1A1IKBKB | |
| SCHEMBL29007934 | 0.71 | NUDT1 (0.54) | NUDT1KDM4DCHEK1ALDH1A1CYP1A2 | |
| SCHEMBL30417616 | 0.71 | NUDT1 (0.54) | NUDT1KDM4DCHEK1ALDH1A1CYP1A2 | |
| SCHEMBL30138380 | 0.71 | CHEK1 (0.52) | NUDT1KDM4DCHEK1ALDH1A1CYP1A2 | |
| SCHEMBL20929505 | 0.71 | CHEK1 (0.52) | NUDT1KDM4DCHEK1ALDH1A1CYP1A2 | |
| SCHEMBL14541839 | 0.71 | UHRF1 (0.56) | NUDT1UHRF1ALDH1A1CYP1A2CLK4 | |
| SCHEMBL19530106 | 0.71 | UHRF1 (0.43) | NUDT1UHRF1NNMT | |
| SCHEMBL8277604 | 0.70 | KDM4D (0.60) | NUDT1KDM4DALDH1A1SMN1; SMN2EGFR | |
| SCHEMBL4858416 | 0.70 | ALDH1A1 (0.65) | NUDT1ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL19530105 | 0.70 | UHRF1 (0.39) | NUDT1UHRF1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-3095158-A | — | — | None | — | — | JP | disclosed |
| JP-H0395158-A | 2,5-DIAMINOPYRIDINE DERIVATIVE, ITS PRODUCTION AND KERATINOUS FIBER DYEING COMPOSITION CONTAINING THE SAME | KAO CORP | 1991-04-19 | — | — | JP | disclosed |