Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 10/20 | 0.38 |
| ▸ | TPSD1 | Q9BZJ3 | 10/20 | 0.38 |
| ▸ | TPSG1 | Q9NRR2 | 10/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22018450 | 0.87 | CYP1A2 (0.46) | TPSAB1TPSD1TPSG1PRSS1F2 | |
| SCHEMBL12849683 | 0.81 | TSHR (0.44) | TP53ALDH1A1HRH3HTTL3MBTL1 | |
| SCHEMBL12820498 | 0.81 | TPSAB1 (0.44) | TPSAB1TPSD1TPSG1PRSS1F2 | |
| SCHEMBL22018451 | 0.80 | TPSAB1 (0.50) | TPSAB1TPSD1TPSG1PRSS1F2 | |
| SCHEMBL21428432 | 0.80 | LMNA (0.47) | TP53TPSAB1TPSD1TPSG1KDM4E | |
| SCHEMBL21428419 | 0.78 | LMNA (0.50) | TP53TPSAB1TPSD1TPSG1KDM4E | |
| SCHEMBL12820463 | 0.78 | SCN1A (0.37) | TP53ALDH1A1ATM | |
| SCHEMBL12820460 | 0.78 | TP53 (0.43) | TP53KDM4EALDH1A1 | |
| SCHEMBL12820099 | 0.78 | L3MBTL3 (0.41) | KDM4EALDH1A1CYP1A2HRH3L3MBTL1 | |
| SCHEMBL12820500 | 0.77 | L3MBTL3 (0.42) | KDM4EALDH1A1CYP1A2HRH3L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012126084-A1 | HSP-90 BINDING COMPOUNDS, COMPOSITIONS THEREOF, AND THEIR USE IΝ THE TREATMENT AND PREVENTION OF FUNGAL INFECTIONS | PHARMASCIENCE INC. (CA) | 2012-09-27 | — | — | WO | disclosed |
| WO-2011035417-A1 | HSP-90 BINDING COMPOUNDS, COMPOSITIONS THEREOF, AND THEIR USE FN THE TREATMENT OF AUTOIMMUNE AND INFLAMMATORY DISEASES | AEGERA THERAPEUTICS INC. (CA) | 2011-03-31 | — | — | WO | disclosed |
| WO-2011035416-A1 | HSP90 MODULATING COMPOUNDS, COMPOSITIONS, METHODS AND USES | AEGERA THERAPEUTICS INC. (CA) | 2011-03-31 | — | — | WO | disclosed |