Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3870311 | 0.82 | SMYD3 (0.36) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL8291616 | 0.82 | SMYD3 (0.36) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL3870308 | 0.82 | SMYD3 (0.36) | SMYD3GAAMAPTRAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL3873506 | 0.81 | SMYD3 (0.36) | SMYD3GAAMAPTRAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL3873511 | 0.81 | SMYD3 (0.36) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL12196253 | 0.72 | CCR5 (0.35) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL5819539 | 0.72 | SMYD3 (0.32) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL5819548 | 0.72 | SMYD3 (0.32) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL5819544 | 0.72 | SMYD3 (0.32) | SMYD3GAAMAPTRAB9AMEN1 | |
| SCHEMBL9963213 | 0.69 | CNR2 (0.49) | RAB9ANPC1CYP2C19HCRTR1HCRTR2 |
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-2005040142-A1 | NOVEL KETO-OXADIAZOLE DERIVATIVES AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2005-05-06 | — | — | WO | disclosed |