Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3717388 | 0.88 | ACACB (0.40) | RAB9AMEN1KMT2AACACBNPC1 | |
| SCHEMBL3721863 | 0.86 | MAPT (0.39) | ALDH1A1RAB9AATMSMN1; SMN2NPC1 | |
| SCHEMBL3717738 | 0.84 | TEC (0.39) | ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3726328 | 0.84 | ACACB (0.40) | CYP1A2ACACBACACA | |
| SCHEMBL3717827 | 0.83 | ALDH1A1 (0.49) | ALDH1A1RAB9AMEN1CYP1A2CYP2D6 | |
| SCHEMBL3719990 | 0.81 | LMNA (0.37) | KDM4CACACBNPC1 | |
| SCHEMBL3726251 | 0.81 | SCN9A (0.33) | CYP1A2CYP2C9CYP2C19ATMACACB | |
| SCHEMBL3720633 | 0.81 | SMN1; SMN2 (0.33) | ALDH1A1RAB9AMEN1CYP1A2CYP2C9 | |
| SCHEMBL3719910 | 0.80 | PPARG (0.37) | ACACBPPARGACACA | |
| SCHEMBL3720131 | 0.80 | PDE4B (0.53) | ALDH1A1RAB9AMEN1CYP1A2CYP2D6 |
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 |