Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.48 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | QPCT | Q16769 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7079281 | 0.84 | ALDH1A1 (0.51) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL6772485 | 0.81 | HSD17B10 (0.46) | ALDH1A1CYP19A1PDGFRBPDGFRAKMT2A | |
| SCHEMBL7761071 | 0.77 | CYP1A2 (0.51) | ALDH1A1PDGFRBPDGFRAKDM4EHSD17B10 | |
| SCHEMBL6769445 | 0.75 | HSD17B10 (0.46) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL9984850 | 0.71 | HSF1 (0.52) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL5258880 | 0.67 | NAMPT (0.59) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL3637194 | 0.67 | LMNA (0.68) | ALDH1A1PDGFRBPDGFRAKMT2AMEN1 | |
| SCHEMBL12330491 | 0.67 | MEN1 (0.70) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL14552420 | 0.66 | MEN1 (0.83) | ALDH1A1CYP19A1KMT2AMEN1KDM4E | |
| SCHEMBL7078467 | 0.66 | PDGFRB (0.56) | ALDH1A1PDGFRBPDGFRAKMT2AMEN1 |
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-2001078648-A2 | 6-METHYLNICOTINAMIDE DERIVATIVES AS ANTIVIRAL AGENTS | DONG WHA PHARM. IND. CO., LTD. (KR) | 2001-10-25 | — | — | WO | disclosed |