Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.54 |
| ▸ | HTR1A | P08908 | 2/20 | 0.54 |
| ▸ | DRD2 | P14416 | 2/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3915606 | 1.00 | MAOB (0.58) | MAOBALDH1A1CYP3A4ABCB1HTR1A | |
| SCHEMBL4053551 | 0.88 | MAOB (0.59) | MAOBCYP3A4RAB9AGAAMAPT | |
| SCHEMBL7291737 | 0.87 | MAOB (0.58) | MAOBALDH1A1CYP3A4RAB9AGAA | |
| SCHEMBL9315251 | 0.87 | MAOB (0.58) | MAOBALDH1A1ABCB1HTR1ADRD2 | |
| SCHEMBL2992089 | 0.85 | MAOB (0.53) | MAOBALDH1A1ABCB1HTR1ADRD2 | |
| SCHEMBL30461777 | 0.85 | MAOB (0.53) | MAOBALDH1A1ABCB1HTR1ADRD2 | |
| SCHEMBL22686870 | 0.84 | MAOB (0.56) | MAOBALDH1A1CYP3A4RAB9AGAA | |
| SCHEMBL30058080 | 0.84 | MAOB (0.50) | MAOBRAB9AGAAMAPTSMN1; SMN2 | |
| SCHEMBL647614 | 0.84 | MAOB (0.50) | MAOBRAB9AGAAMAPTSMN1; SMN2 | |
| SCHEMBL13791570 | 0.83 | MAOB (0.62) | MAOBALDH1A1ABCB1HTR1ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |