Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 10/20 | 0.85 |
| ▸ | SLCO1B3 | Q9NPD5 | 7/20 | 0.85 |
| ▸ | SLCO1B1 | Q9Y6L6 | 7/20 | 0.85 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.85 |
| ▸ | TP53 | P04637 | 4/20 | 0.85 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.85 |
| ▸ | USP2 | O75604 | 6/20 | 0.65 |
| ▸ | MAPT | P10636 | 4/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | MIF | P14174 | 1/20 | 0.56 |
| ▸ | GSK3B | P49841 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17616912 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL9973669 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL20639350 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL598727 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL14197006 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL10019478 | 0.92 | CYP3A4 (1.00) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| SCHEMBL17368654 | 0.87 | CYP3A4 (0.74) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| Azadiradione SCHEMBL19588462 | 0.85 | CYP3A4 (0.77) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| Azadiradione SCHEMBL29398035 | 0.85 | CYP3A4 (0.77) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 | |
| Azadiradione SCHEMBL15941112 | 0.85 | CYP3A4 (0.77) | CYP3A4SLCO1B3SLCO1B1SMN1; SMN2TP53 |
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-8609870-B2 | Treating various disorders using TrkB agonists | EMORY UNIVERSITY (US) | 2013-12-17 | — | — | US | disclosed |
| US-8203009-B2 | Neurotrophic activity of deoxygedunin | EMORY UNIVERSITY (US) | 2012-06-19 | — | — | US | disclosed |