Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KDR | P35968 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 2/20 | 0.53 |
| ▸ | RECQL | P46063 | 2/20 | 0.53 |
| ▸ | CASP1 | P29466 | 2/20 | 0.53 |
| ▸ | TNF | P01375 | 1/20 | 0.53 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.53 |
| ▸ | CASP7 | P55210 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29018867 | 0.86 | MAPT (0.52) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL1551321 | 0.85 | ALDH1A1 (0.48) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL7754586 | 0.83 | MAPT (0.48) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL3245649 | 0.82 | PIM1 (0.47) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL8995644 | 0.81 | MAOB (0.54) | ALDH1A1KMT2ATDP1MEN1PTGS2 | |
| SCHEMBL11374507 | 0.81 | PTGS2 (0.49) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| Hydrochloric Acid SCHEMBL27295009 | 0.80 | PIM1 (0.46) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL7758544 | 0.79 | MAPT (0.44) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL7551541 | 0.79 | KDM4E (0.46) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 | |
| SCHEMBL10706035 | 0.77 | MAPT (0.43) | ALDH1A1KMT2ACYP3A4KDM4ETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0075808-A2 | 3,6-Dioxo-1,2-dihydro-7H-pyrazolo(3,4-b)pyridine dyes | BAYER AG (DE) | 1983-04-06 | — | — | EP | disclosed |