Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 10/20 | 0.90 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17277628 | 0.95 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| SCHEMBL15711340 | 0.95 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| SCHEMBL17835134 | 0.85 | APEX1 (0.67) | APEX1 | |
| SCHEMBL14135227 | 0.85 | APEX1 (0.67) | APEX1 | |
| SCHEMBL3755865 | 0.85 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| SCHEMBL3755868 | 0.85 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| SCHEMBL13049451 | 0.81 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| Apx-3330 SCHEMBL3758716 | 0.80 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| Apx-3330 SCHEMBL3758719 | 0.80 | APEX1 (1.00) | APEX1MAPTTDP1ALDH1A1THRB | |
| SCHEMBL15705626 | 0.80 | APEX1 (0.70) | APEX1MAPTTDP1ALDH1A1THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-9315481-B2 | Compounds and methods for treating leukemia | INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) | 2016-04-19 | — | — | US | disclosed |