Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | NPY2R | P49146 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL901909 | 0.77 | MEN1 (0.41) | KMT2AMEN1HTTKDM4EALDH1A1 | |
| SCHEMBL11807767 | 0.71 | GABRA1 (0.46) | ALOX15HSD17B10GABRA1GABRB2LMNA | |
| SCHEMBL21795251 | 0.70 | MAPT (0.42) | KMT2AMEN1HTTKDM4EALDH1A1 | |
| SCHEMBL26156490 | 0.69 | KDM4E (0.47) | KMT2AMEN1HTTKDM4EALDH1A1 | |
| SCHEMBL21884099 | 0.69 | GABRA1 (0.43) | HTTALOX15HSD17B10GABRA1GABRB2 | |
| SCHEMBL15961518 | 0.68 | RIPK1 (0.51) | KMT2AMEN1HTTKDM4EALDH1A1 | |
| SCHEMBL11591624 | 0.67 | MEN1 (0.50) | KMT2AMEN1HTTALDH1A1HPGD | |
| SCHEMBL10799329 | 0.67 | GABRA1 (0.42) | ALOX15GABRA1GABRB2LMNA | |
| Hydrochloric Acid SCHEMBL11592148 | 0.66 | MEN1 (0.49) | KMT2AMEN1HTTALDH1A1NPY1R | |
| SCHEMBL27642496 | 0.65 | HSPA5 (0.49) | KMT2AMEN1HTTKDM4EALDH1A1 |
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-2017017043-A1 | NOVEL 6,7-DIHYDROPYRIDO[2,1-A]PHTHALAZIN-2-ONES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION | F. HOFFMANN-LA ROCHE AG (CH) | 2017-02-02 | — | — | WO | disclosed |