Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.32 |
| ▸ | GRK5 | P34947 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 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 | |
|---|---|---|---|---|
| SCHEMBL6139488 | 1.00 | KIF11 (0.35) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL6139367 | 0.92 | TSHR (0.38) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL7749385 | 0.89 | KIF11 (0.38) | KIF11FFAR1TSHRCYP2C19CASP1 | |
| SCHEMBL8445608 | 0.89 | TSHR (0.40) | KIF11TSHRCASP1HSD17B10POLB | |
| SCHEMBL7749391 | 0.85 | MIF (0.37) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL7957554 | 0.84 | SLC6A2 (0.32) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL7077078 | 0.84 | SLC6A2 (0.32) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL6544463 | 0.82 | L3MBTL1 (0.41) | FFAR1ALDH1A1ESR1CYP3A4ESR2 | |
| SCHEMBL6955463 | 0.82 | ALDH1A1 (0.35) | KIF11FFAR1ALDH1A1ESR1CYP3A4 | |
| SCHEMBL7137116 | 0.82 | ALDH1A1 (0.35) | KIF11FFAR1ALDH1A1ESR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6262046-B1 | Azetidinylpropylpiperidine derivatives, intermediates and use as tachykinin antagonists | PFIZER INC. | 2001-07-17 | — | — | US | disclosed |