Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 10/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12134458 | 0.84 | CYP19A1 (0.67) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL12134462 | 0.77 | PTGS2 (0.51) | PTGS2ABCG2CYP19A1CYP3A4ESR1 | |
| SCHEMBL5522119 | 0.77 | LMNA (0.53) | PTGS2CYP1A2MAPTRAB9AMEN1 | |
| SCHEMBL10780099 | 0.77 | PTGS2 (0.76) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL641722 | 0.76 | CYP19A1 (0.73) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL641723 | 0.76 | CYP19A1 (0.73) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL12468690 | 0.76 | CYP19A1 (0.73) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL12134449 | 0.75 | FFAR1 (0.43) | NPC1RAB9AMEN1KMT2APOLB | |
| SCHEMBL25403443 | 0.75 | ESR1 (0.78) | PTGS2CYP19A1CYP3A4ESR1ESR2 | |
| SCHEMBL30829209 | 0.74 | PREP (0.41) | CYP19A1CYP3A4ESR1ESR2MAPT |
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-8063249-B1 | Substituted triphenyl butenes | OLEMA PHARMACEUTICALS, INC. (US) | 2011-11-22 | — | — | US | disclosed |