Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7927069 | 0.89 | CYP3A4 (0.32) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL7929761 | 0.86 | CYP3A4 (0.36) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL7929676 | 0.83 | CYP2D6 (0.37) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL7929744 | 0.81 | CYP2D6 (0.36) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL3732682 | 0.81 | CYP2D6 (0.36) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL6445244 | 0.81 | — | — | |
| SCHEMBL7928139 | 0.80 | TRPV1 (0.32) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| Hydrochloric Acid SCHEMBL3732684 | 0.80 | CYP2D6 (0.37) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL3735377 | 0.78 | CYP2D6 (0.34) | CYP2D6CYP3A4CYP2C9TSHRCYP2C19 | |
| SCHEMBL6447641 | 0.77 | SLC22A2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1153938-A1 | CATALYST FOR STEREOREGULAR POLYMERIZATION OF ALPHA-OLEFIN AND PROCESS FOR PRODUCING STEREOREGULAR ALPHA-OLEFIN POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-11-14 | — | — | EP | disclosed |