Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3720271 | 0.88 | PDE4B (0.42) | PDE4BSMN1; SMN2LMNACYP1A2CYP2C19 | |
| SCHEMBL3719889 | 0.87 | PDE4B (0.42) | PDE4BSMN1; SMN2LMNACYP1A2CYP2C19 | |
| SCHEMBL3720632 | 0.83 | PDE4B (0.53) | PDE4BSMN1; SMN2LMNACYP1A2CYP2C19 | |
| SCHEMBL3802819 | 0.83 | ACACB (0.37) | SMN1; SMN2LMNACYP1A2CYP2C19HIF1A | |
| SCHEMBL3719548 | 0.83 | PDE4B (0.48) | PDE4BSMN1; SMN2HDAC3HDAC4HDAC1 | |
| SCHEMBL3716931 | 0.81 | PDE4B (0.42) | PDE4BSMN1; SMN2CYP1A2CYP2C19HDAC3 | |
| SCHEMBL3720538 | 0.80 | LMNA (0.31) | SMN1; SMN2LMNACYP1A2CYP2C19HIF1A | |
| SCHEMBL3720159 | 0.80 | PDE4B (0.42) | PDE4BSMN1; SMN2HDAC3HDAC4HDAC1 | |
| SCHEMBL3716835 | 0.78 | PDE4B (0.53) | PDE4BSMN1; SMN2HDAC3HDAC4HDAC1 | |
| SCHEMBL3727697 | 0.78 | CYP1A2 (0.34) | SMN1; SMN2LMNACYP1A2KMT2AMEN1 |
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-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |