Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9562993 | 0.88 | CYP1A2 (0.41) | ADORA3ADORA1ALDH1A1KMT2AKDM4E | |
| SCHEMBL9562980 | 0.86 | ADORA3 (0.42) | ADORA3ADORA1ALDH1A1KMT2APOLB | |
| SCHEMBL9589280 | 0.84 | ADORA3 (0.41) | ADORA3ADORA1ALDH1A1KMT2APOLB | |
| SCHEMBL9562978 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL9562990 | 0.83 | PTGES (0.47) | ALDH1A1 | |
| SCHEMBL9562977 | 0.83 | ADORA3 (0.45) | ADORA3ADORA1ALDH1A1KDM4EMAPT | |
| SCHEMBL9706622 | 0.81 | ALDH1A1 (0.43) | ADORA3ADORA1ALDH1A1POLBKDM4E | |
| SCHEMBL9573157 | 0.80 | GAA (0.53) | ADORA3ADORA1ALDH1A1POLBKDM4E | |
| SCHEMBL9706694 | 0.80 | ALDH1A1 (0.43) | ADORA3ADORA1ALDH1A1POLBKDM4E | |
| SCHEMBL8943560 | 0.78 | ALDH1A1 (0.41) | ADORA3ADORA1ALDH1A1POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0573837-A1 | Acetal-containing pyrimidinylthioaliphatic acid derivatives useful as herbicides | NIHON BAYER AGROCHEM K.K. (JP) | 1993-12-15 | — | — | EP | claimed |
| EP-0573837-A1 | Acetal-containing pyrimidinylthioaliphatic acid derivatives useful as herbicides | NIHON BAYER AGROCHEM K.K. (JP) | 1993-12-15 | — | — | EP | disclosed |