Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 12/20 | 0.38 |
| ▸ | CDK2AP1 | O14519 | 4/20 | 0.38 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.36 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6015247 | 0.82 | KDM4E (0.48) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL1564538 | 0.81 | CHEK1 (0.53) | CHEK1CDK2AP1 | |
| SCHEMBL6015282 | 0.80 | KDM4E (0.46) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL6015246 | 0.78 | CHEK1 (0.48) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL6015249 | 0.76 | PIK3CD (0.46) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL6015274 | 0.75 | KMT2A (0.44) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL6015237 | 0.74 | KDM4E (0.49) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL6015245 | 0.70 | KDM4E (0.49) | KMT2AKDM4EMAPTATMCYP2D6 | |
| SCHEMBL440540 | 0.68 | — | — | |
| SCHEMBL1405881 | 0.68 | — | — |
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-1732920-A2 | THIOPHENE DERIVATIVES AS CHK 1 INHIBITORS | AstraZeneca AB (SE) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005066163-A2 | THIOPHENE DERIVATIVES AS CHK 1 INIHIBITORS | ASTRAZENECA AB (SE) | 2005-07-21 | — | — | WO | disclosed |