Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | IL1RN | P18510 | 1/20 | 0.37 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL19798391 | 0.80 | CA1 (0.55) | KEAP1CA12CA7CA9CA14 | |
| SCHEMBL20724723 | 0.79 | AR (0.45) | KEAP1CA12CA7CA9CA1 | |
| SCHEMBL19798396 | 0.78 | KEAP1 (0.42) | KEAP1CA12CA9POLBCA1 | |
| SCHEMBL29124111 | 0.78 | PPARA (0.55) | CA12CA7CA9CA14CA1 | |
| SCHEMBL15444483 | 0.77 | KEAP1 (0.42) | KEAP1CA12CA7CA14POLB | |
| SCHEMBL15592740 | 0.76 | KEAP1 (0.46) | KEAP1CA12CA7CA9CA1 | |
| SCHEMBL28044679 | 0.75 | KEAP1 (0.48) | KEAP1CA12CA7CA9CA14 | |
| SCHEMBL17199172 | 0.73 | KEAP1 (0.47) | KEAP1CA12CA7CA9CA14 | |
| SCHEMBL7835580 | 0.73 | CA2 (0.45) | KEAP1CA12CA7CA9CA14 | |
| SCHEMBL19798740 | 0.73 | MAPK1 (0.43) | KEAP1CA12CA7CA14POLB |
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-1303496-A1 | PYRIMIDINE DERIVATIVES | AstraZeneca AB (SE) | 2003-04-23 | — | — | EP | disclosed |
| WO-2002004429-A1 | PYRIMIDINE DERIVATIVES | ASTRAZENECA AB (SE) | 2002-01-17 | — | — | WO | disclosed |