Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8626864 | 0.80 | CYP3A4 (0.55) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL7592350 | 0.79 | TSHR (0.52) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL18209192 | 0.78 | CETP (0.41) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL21169213 | 0.77 | CETP (0.47) | CETPTSHRMAPK1TAAR1HTR2A | |
| SCHEMBL10700469 | 0.77 | MEN1 (0.54) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL10734840 | 0.77 | CETP (0.47) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL10504615 | 0.76 | NR1H2 (0.50) | TSHRARALDH1A1 | |
| SCHEMBL9500069 | 0.76 | CETP (0.46) | CETPTSHRMAPK1TAAR1IDO1 | |
| SCHEMBL23502231 | 0.75 | CES2 (0.48) | CETPTSHRMAPK1TAAR1CES2 | |
| SCHEMBL171829 | 0.75 | TSHR (0.48) | CETPTSHRMAPK1CES2MGLL |
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-2005090282-A1 | ANDROGEN RECEPTOR MODULATOR COMPOUNDS AND METHODS | LIGAND PHARMACEUTICALS INCORPORATED (US) | 2005-09-29 | — | — | WO | disclosed |