Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.38 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16347324 | 1.00 | MAOB (0.38) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL11664007 | 0.74 | MAOB (0.48) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL2517164 | 0.74 | MAOB (0.48) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL2517168 | 0.74 | MAOB (0.48) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL27842310 | 0.73 | MAOB (0.46) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL8927292 | 0.65 | TBXAS1 (0.48) | MAOBCYP19A1CYP1A2CYP2D6MAPT | |
| (Z)-1,2-Diphenylethene SCHEMBL28743228 | 0.65 | MAOB (0.69) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| (Z)-1,2-Diphenylethene SCHEMBL27373856 | 0.65 | MAOB (0.69) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL920604 | 0.65 | MAOB (0.52) | MAOBMAOAALDH1A1LMNANFE2L2 | |
| SCHEMBL48799 | 0.65 | MAOB (0.52) | MAOBMAOAALDH1A1LMNANFE2L2 |
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-3016934-A2 | HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME | Millennium Pharmaceuticals, Inc. (US) | 2016-05-11 | — | — | EP | disclosed |
| WO-2015002994-A2 | HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2015-01-08 | — | — | WO | disclosed |