Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL21408149 | 0.87 | KDM1A (0.41) | KDM1ACTSKUSP2SMN1; SMN2PDE4A | |
| SCHEMBL21408126 | 0.83 | KDM1A (0.41) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL21408124 | 0.83 | KDM1A (0.41) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL25281708 | 0.81 | KDM1A (0.40) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL21408160 | 0.80 | CTSK (0.38) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL25232243 | 0.79 | KDM1A (0.41) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL25307149 | 0.79 | KDM1A (0.39) | KDM1ACTSKUSP2SMN1; SMN2HPGD | |
| SCHEMBL21408133 | 0.77 | KDM1A (0.40) | KDM1ACTSKUSP2SMN1; SMN2PDE4A | |
| SCHEMBL20456330 | 0.76 | KDM1A (0.43) | KDM1ACTSKUSP2SMN1; SMN2PDE4A | |
| SCHEMBL29424761 | 0.76 | USP30 (0.40) | KDM1ACTSKUSP2SMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018214867-A9 | N-(AZAARYL)CYCLOLACTAM-1-CARBOXAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 上海和誉生物医药科技有限公司 | 2019-10-03 | — | — | WO | disclosed |