Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PSMD14 | O00487 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7589324 | 0.80 | KDM4E (0.57) | PARP1KDM4E | |
| SCHEMBL344417 | 0.80 | PARP1 (0.58) | PARP1LMNAALDH1A1DHODHKDM4E | |
| SCHEMBL10701569 | 0.78 | PARP1 (0.52) | PARP1LMNAPSMD14ALDH1A1KDM4E | |
| SCHEMBL345367 | 0.77 | PARP1 (0.55) | PARP1LMNAALDH1A1KDM4E | |
| SCHEMBL368304 | 0.77 | PARP1 (0.51) | PARP1LMNAPSMD14ALDH1A1KDM4E | |
| SCHEMBL8099182 | 0.77 | PDE4A (0.40) | PARP1PSMD14ALDH1A1HPGDSKDM4E | |
| SCHEMBL8811070 | 0.77 | HPGDS (0.56) | PARP1LMNAALDH1A1HPGDS | |
| SCHEMBL8838482 | 0.77 | PDE10A (0.44) | PARP1LMNAPSMD14HPGDSKDM4E | |
| SCHEMBL9355371 | 0.76 | PARP1 (0.74) | PARP1PSMD14ALDH1A1KDM4E | |
| SCHEMBL9124270 | 0.75 | PARP1 (0.59) | PARP1PSMD14ALDH1A1HPGDSKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105732492-A | Synthesis method of 5-methoxy methyl pyridine-2,3-diethyl phthalate | 常州市蓝勖化工有限公司 | 2016-07-06 | — | — | CN | disclosed |