Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | TIPARP | Q7Z3E1 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8852150 | 0.83 | MTOR (0.39) | PIK3CAPIK3CDPIK3CGMTORSCN9A | |
| SCHEMBL8851865 | 0.81 | MAPK1 (0.44) | LMNAPDE10ASCN9AKDM4EMEN1 | |
| SCHEMBL8851147 | 0.79 | HTT (0.47) | AURKAPIK3CALMNAKDM4EMEN1 | |
| SCHEMBL8851858 | 0.77 | PTK2 (0.46) | AURKARPS6KB1PIK3CALMNAPDE10A | |
| SCHEMBL8851850 | 0.74 | ADK (0.36) | AURKARPS6KB1PIK3CALMNAKDM4E | |
| SCHEMBL7938993 | 0.73 | KDM4E (0.49) | AURKARPS6KB1PIK3CAPDE10AKDM4E | |
| SCHEMBL8851569 | 0.71 | SMN1; SMN2 (0.51) | PIK3CAMTORLMNAPDE10AKMT2A | |
| SCHEMBL8851920 | 0.70 | MAPK1 (0.37) | PIK3CAPIK3CGMTORLMNAKDM4E | |
| SCHEMBL8851853 | 0.68 | PTK2 (0.45) | AURKARPS6KB1PIK3CALMNAPDE10A | |
| SCHEMBL8850966 | 0.66 | ADK (0.43) | AURKARPS6KB1PIK3CAPDE10AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5618814-A | Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds | DR. KARL THOMAE GMBH (DE) | 1997-04-08 | — | — | US | disclosed |
| EP-0645390-A1 | Trisubstituted pyrimido 5,4-d pyrimidines for modulating multidrug resistance, drugs containing these compounds and processes for their preparation | Dr. Karl Thomae GmbH (DE) | 1995-03-29 | — | — | EP | disclosed |