Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.57 |
| ▸ | AR | P10275 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL2879029 | 0.92 | ABCG2 (0.67) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL5085606 | 0.91 | CYP19A1 (0.63) | MAOBCYP19A1CYP3A4MAPTABCG2 | |
| SCHEMBL16894664 | 0.85 | MAOB (0.60) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL3368230 | 0.81 | CYP19A1 (0.59) | CYP19A1CYP3A4NPC1MAPTRAB9A | |
| SCHEMBL773767 | 0.81 | CYP19A1 (0.66) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL6700335 | 0.80 | ABCG2 (0.65) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL22680315 | 0.80 | ABCB1 (0.87) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL17318042 | 0.80 | CYP1A1 (0.67) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL7200859 | 0.80 | CYP1A1 (0.67) | MAOBCYP19A1CYP3A4NPC1MAPT | |
| SCHEMBL18106040 | 0.79 | ALDH1A1 (0.83) | MAOBCYP19A1CYP3A4NPC1MAPT |
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-6677350-B1 | ADMINISTERING CHALCONE-LIKE VINYLCARBONYL COMPOUNDS TO PREVENT OR TREAT MYCOBACTERIUM INFECTIONS/TUBERCULOSIS | ADVANCED LIFE SCIENCES, INC. | 2004-01-13 | — | — | US | disclosed |