Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 10/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | AR | P10275 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9530592 | 0.72 | BRD4 (0.40) | MAOBKDM4ETSHRNPC1MAPT | |
| SCHEMBL20768161 | 0.72 | P2RY6 (0.33) | — | |
| SCHEMBL5114229 | 0.72 | TSHR (0.46) | MAOBADORA3KDM4EHSD17B10AR | |
| SCHEMBL403523 | 0.68 | MAOB (0.65) | MAOBADORA3KDM4EHSD17B10AR | |
| SCHEMBL32498549 | 0.68 | MAOB (0.65) | MAOBADORA3KDM4EHSD17B10AR | |
| SCHEMBL2478986 | 0.68 | LTA4H (0.61) | — | |
| SCHEMBL9531349 | 0.68 | POLB (0.40) | NPC1CYP3A4MAPTMAPK1RAB9A | |
| SCHEMBL6639183 | 0.67 | SIRT1 (0.43) | — | |
| Water SCHEMBL6439945 | 0.67 | MAOB (0.62) | MAOBADORA3KDM4EHSD17B10AR | |
| SCHEMBL9532685 | 0.66 | POLB (0.38) | MAPTHPGD |
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-7132446-B1 | Isolation of a dimer di-gallate, a potent endothelium-dependent vasorelaxing compound | UNIVERSITY OF SOUTH FLORIDA (US) | 2006-11-07 | — | — | US | disclosed |