Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.48 |
| ▸ | CDK9 | P50750 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | PRKACA | P17612 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5229810 | 0.81 | HSP90AA1 (0.62) | KMOCCNT1CCNA2CDK2CDK9 | |
| SCHEMBL28547944 | 0.81 | KMO (0.63) | KMOMAP4K4MEN1KMT2AKDM4E | |
| SCHEMBL20150481 | 0.78 | MAP4K4 (0.68) | MAP4K4MEN1KMT2AKDM4EMAPT | |
| SCHEMBL4903504 | 0.77 | KMO (0.70) | KMOHPGDS | |
| SCHEMBL28483057 | 0.75 | NPC1 (0.61) | KMOMEN1KMT2AKDM4EMAPT | |
| SCHEMBL4901724 | 0.75 | KMO (0.64) | KMOMEN1KMT2AKDM4EMAPT | |
| SCHEMBL13155157 | 0.74 | MAP4K4 (0.50) | KMOMAP4K4MEN1KMT2AKDM4E | |
| SCHEMBL30933626 | 0.74 | MAP4K4 (0.50) | KMOMAP4K4MEN1KMT2AKDM4E | |
| SCHEMBL25649075 | 0.74 | NPC1 (0.46) | KMOKMT2AADORA2ABCHEACHE | |
| SCHEMBL27854208 | 0.74 | KMO (0.44) | KMOMEN1KMT2AKDM4EMAPT |
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-1668000-A1 | PYRIMIDIN-2-AMINE DERIVATIVES AND THEIR USE AS A2B ADENOSINE RECEPTOR ANTAGONISTS | Almirall Prodesfarma, S.A. (ES) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005040155-A1 | PYRIMIDIN-2-AMINE DERIVATES AND THEIR USE AS A2B ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL PRODESFARMA, S.A. (ES) | 2005-05-06 | — | — | WO | disclosed |