Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CDC25A | P30304 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | CCL2 | P13500 | 3/20 | 0.33 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28375751 | 0.76 | CNR2 (0.41) | CNR2CNR1CDC25ABRD4CCL2 | |
| SCHEMBL16872444 | 0.76 | CNR2 (0.41) | CNR2CNR1CDC25ABRD4CCL2 | |
| SCHEMBL11036624 | 0.71 | ATM (0.46) | CNR2CNR1CDC25ABRD4CCL2 | |
| SCHEMBL15924493 | 0.70 | HDAC3 (0.55) | SETD7GAAALDH1A1TP53APAF1 | |
| SCHEMBL28570346 | 0.70 | BRD4 (0.40) | CNR2CNR1BRD4CCL2GAA | |
| SCHEMBL29112005 | 0.69 | LTA4H (0.46) | ALDH1A1TP53TSHRHTTAPAF1 | |
| SCHEMBL10688105 | 0.65 | BRD4 (0.46) | BRD4CCL2GAAALDH1A1TP53 | |
| SCHEMBL28291072 | 0.65 | L3MBTL1 (0.47) | ALDH1A1TP53TSHRHTTAPAF1 | |
| SCHEMBL31740759 | 0.64 | EYA2 (0.50) | CNR2CNR1ALDH1A1TP53TSHR | |
| SCHEMBL15923132 | 0.64 | CES1 (0.57) | CDC25AALDH1A1RAB9AL3MBTL1CYP1A2 |
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-2950649-A2 | AMINE COMPOUNDS HAVING ANTI-INFLAMMATORY, ANTIFUNGAL, ANTIPARASITIC AND ANTICANCER ACTIVITY | Wellstat Therapeutics Corporation (US) | 2015-12-09 | — | — | EP | disclosed |
| WO-2014120995-A2 | AMINE COMPOUNDS HAVING ANTI-INFLAMMATORY, ANTIFUNGAL, ANTIPARASITIC AND ANTICANCER ACTIVITY | WELLSTAT THERAPEUTICS CORPORATION (US) | 2014-08-07 | — | — | WO | disclosed |