Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 1/20 | 0.43 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | HTR3A | P46098 | 6/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 4/20 | 0.40 |
| ▸ | HTR3B | O95264 | 4/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 4/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 4/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8313992 | 0.72 | XIAP (0.51) | XIAPBIRC2PARP1KDM4ECREBBP | |
| SCHEMBL9109680 | 0.72 | XIAP (0.51) | XIAPBIRC2PARP1KDM4ECREBBP | |
| SCHEMBL8316117 | 0.71 | XIAP (0.50) | XIAPBIRC2PARP1CREBBPBRD4 | |
| SCHEMBL21253073 | 0.71 | XIAP (0.50) | XIAPBIRC2PARP1ALDH1A1CREBBP | |
| SCHEMBL21253074 | 0.71 | XIAP (0.50) | XIAPBIRC2PARP1ALDH1A1CREBBP | |
| SCHEMBL10072964 | 0.64 | OGA (0.50) | PARP1HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL17854806 | 0.64 | XIAP (0.55) | XIAPBIRC2KDM4EALDH1A1CREBBP | |
| SCHEMBL9111698 | 0.64 | XIAP (0.55) | XIAPBIRC2KDM4EALDH1A1CREBBP | |
| SCHEMBL14765037 | 0.63 | GSK3B (0.76) | XIAPBIRC2PARP1ALDH1A1CYP1A2 | |
| SCHEMBL25138077 | 0.63 | HTR3A (0.70) | PARP1HTR3AHTR3EHTR3BHTR3D |
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-5424311-A | A viricides for treating viral diseases; HIV enzyme inhibitor | HOESCHST AKTIENGESELLSCHAFT (DE) | 1995-06-13 | — | — | US | disclosed |
| EP-0590428-A1 | Azaquinoxalines, process for their preparation, and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-04-06 | — | — | EP | disclosed |