Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | BRD4 | O60885 | 2/20 | 0.58 |
| ▸ | PDE4A | P27815 | 3/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.57 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.57 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.57 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CNOT7 | Q9UIV1 | 9/20 | 0.55 |
| ▸ | BRD2 | P25440 | 1/20 | 0.51 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.51 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL556874 | 0.89 | BRD4 (0.66) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL515898 | 0.87 | PDE4A (0.69) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27600173 | 0.86 | BRD4 (0.70) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27600284 | 0.84 | ALDH1A1 (0.70) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27256844 | 0.84 | MAPK1 (0.86) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27600302 | 0.83 | KDM4E (0.60) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27600221 | 0.82 | KDM4E (0.58) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL27583058 | 0.82 | KDM4E (0.58) | KDM4ELMNAPOLBMAPK1BRD4 | |
| SCHEMBL28749916 | 0.80 | ALDH1A1 (0.73) | LMNAPOLBPDE4AADORA2APDE4B | |
| SCHEMBL28749938 | 0.80 | LMNA (0.64) | KDM4ELMNAPOLBMAPK1BRD4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101293888-B | Xanthine derivative, production and use thereof as a medicament | BOEHRINGER INGELHEIM PHARMA | 2013-09-25 | — | — | CN | disclosed |
| CN-101293888-A | Xanthine derivative, production and use thereof as a medicament | BOEHRINGER INGELHEIM PHARMA (DE) | 2008-10-29 | — | — | CN | disclosed |
| CN-100408579-C | Xanthine derivatives, process for their preparation and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM PHARMA (DE) | 2008-08-06 | — | — | CN | disclosed |
| CN-1492870-A | Xanthine derivatives, process for their preparation and their use as pharmaceutical compositions | ���ָ��Ӣ��ķ�������Ϲ�˾ | 2004-04-28 | — | — | CN | disclosed |