Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL3720189 | 0.87 | TSHR (0.34) | TSHRCYP1A2CYP3A4NFKB1KDM4E | |
| SCHEMBL3717155 | 0.84 | ALDH1A1 (0.34) | CYP1A2LMNASMN1; SMN2TYMSMAP4K4 | |
| SCHEMBL3720646 | 0.81 | GLA (0.43) | GLASMN1; SMN2MAP4K4TLR8 | |
| SCHEMBL3719341 | 0.80 | SMN1; SMN2 (0.47) | TSHRCYP1A2CYP3A4NFKB1KDM4E | |
| SCHEMBL3720741 | 0.79 | FFAR4 (0.36) | TSHRCYP1A2CYP3A4NFKB1KDM4E | |
| SCHEMBL3720649 | 0.79 | GPBAR1 (0.35) | TSHRCYP1A2CYP3A4NFKB1KDM4E | |
| SCHEMBL3726861 | 0.79 | MAPT (0.32) | ATMLMNATYMSMAP4K4MAPK14 | |
| SCHEMBL3717668 | 0.78 | CYP1A2 (0.37) | TSHRCYP1A2CYP3A4NFKB1KDM4E | |
| SCHEMBL3717153 | 0.78 | PDE4B (0.43) | TSHRLMNAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3720725 | 0.78 | ACACB (0.38) | TSHRCYP1A2CYP3A4NFKB1KDM4E |
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 |