Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 3/20 | 0.40 |
| ▸ | NOS2 | P35228 | 3/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718613 | 0.95 | HRH3 (0.41) | KEAP1NFE2L2NOS1NOS2HRH3 | |
| SCHEMBL3720646 | 0.90 | GLA (0.43) | GLASMN1; SMN2MAP4K4 | |
| SCHEMBL3726793 | 0.86 | ADRB2 (0.40) | KEAP1NFE2L2NOS1NOS2HRH3 | |
| SCHEMBL3717292 | 0.85 | MCHR1 (0.36) | NFE2L2GLASMN1; SMN2MAP4K4 | |
| SCHEMBL3720725 | 0.84 | ACACB (0.38) | NOS1KDM4EGLASMN1; SMN2ALDH1A1 | |
| SCHEMBL3718230 | 0.84 | MTNR1A (0.48) | HRH3KDM4EALDH1A1 | |
| SCHEMBL3720741 | 0.82 | FFAR4 (0.36) | NOS1KDM4EGLASMN1; SMN2 | |
| SCHEMBL3717668 | 0.81 | CYP1A2 (0.37) | KDM4EGLASMN1; SMN2MAP4K4 | |
| SCHEMBL3720552 | 0.81 | SCN7A (0.46) | MAP4K4 | |
| SCHEMBL3724672 | 0.81 | MAPT (0.39) | HRH3KDM4ESMN1; SMN2ALDH1A1 |
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 |