Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 4/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.50 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.50 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.50 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13458816 | 0.98 | TOP1 (0.58) | TOP1ADORA2AADORA1ALDH1A3MKNK1 | |
| SCHEMBL13458983 | 0.98 | TOP1 (0.58) | TOP1ADORA2AADORA1ALDH1A3MKNK1 | |
| SCHEMBL12112655 | 0.91 | ACACA (0.51) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL13366143 | 0.89 | TOP1 (0.51) | TOP1ADORA2AADORA1ALDH1A3MKNK1 | |
| SCHEMBL3358750 | 0.89 | ACACA (0.50) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL17899330 | 0.89 | ACACA (0.50) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL3698074 | 0.89 | ACACA (0.50) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL3358457 | 0.89 | ACACA (0.50) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL1745982 | 0.89 | ACACA (0.50) | TOP1ADORA2AADORA1SQORHPGD | |
| SCHEMBL23942 | 0.89 | TOP1 (0.50) | TOP1ADORA2AADORA1SQORHPGD |
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-2161272-A1 | Phenanthrolines | BASF SE (DE) | 2010-03-10 | — | — | EP | disclosed |
| EP-2161272-A1 | Phenanthrolines | BASF SE (DE) | 2010-03-10 | — | — | EP | disclosed |