Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLO1 | Q04760 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.42 |
| ▸ | TOP1 | P11387 | 2/20 | 0.41 |
| ▸ | TOP2A | P11388 | 3/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.40 |
| ▸ | CCR8 | P51685 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | GCGR | P47871 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11991166 | 0.87 | TOP1 (0.40) | GLO1ALDH1A1KDM4EGAASMN1; SMN2 | |
| SCHEMBL20726740 | 0.83 | CCR1 (0.49) | GLO1ALDH1A1KDM4ESMN1; SMN2TOP1 | |
| SCHEMBL10032425 | 0.81 | IKBKB (0.52) | GLO1ALDH1A1CYP17A1TOP1TOP2A | |
| SCHEMBL16460158 | 0.81 | TOP1 (0.42) | GLO1CYP17A1TOP1TOP2AMAPK14 | |
| SCHEMBL31403405 | 0.79 | RPS6KA3 (0.48) | SMN1; SMN2TOP2ACCR1CCR5CCR8 | |
| SCHEMBL28313158 | 0.79 | GLO1 (0.47) | GLO1ALDH1A1KDM4ESMN1; SMN2TOP2A | |
| SCHEMBL3289250 | 0.79 | PIK3CA (0.53) | GLO1TOP1TOP2ACCR1CCR5 | |
| SCHEMBL14552117 | 0.79 | COMT (0.57) | TOP2ACCR1CCR5CCR8MAPT | |
| SCHEMBL13474681 | 0.79 | TOP2A (0.41) | GLO1TOP2ACCR1CCR5CCR8 | |
| SCHEMBL3357430 | 0.79 | TOP2A (0.41) | ALDH1A1SMN1; SMN2TOP2ACCR1CCR5 |
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 1 patent. 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 |