Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 19/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 11/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | PLD2 | O14939 | 1/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | C5 | P01031 | 1/20 | 0.52 |
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6836408 | 0.90 | ESR1 (0.55) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL8310884 | 0.87 | ESR1 (0.52) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL14559000 | 0.86 | ESR1 (0.70) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL6765919 | 0.85 | ESR1 (0.56) | ESR1ESR2MEN1KMT2ATDP1 | |
| Hydrochloric Acid SCHEMBL6767212 | 0.84 | ESR1 (0.55) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL7967875 | 0.83 | ESR1 (0.49) | ESR1ESR2MEN1KMT2ATDP1 | |
| 1,2-Dichloroethane SCHEMBL6766357 | 0.81 | ESR1 (0.53) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL6835772 | 0.81 | ESR1 (0.53) | ESR1ESR2MEN1KMT2ATDP1 | |
| SCHEMBL11185523 | 0.80 | ESR1 (0.64) | ESR1ESR2MEN1KMT2ATDP1 | |
| Chlorobenzene SCHEMBL6765632 | 0.79 | ESR1 (0.49) | ESR1ESR2MEN1KMT2ATDP1 |
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-20200030259-A1 | Antiestrogens and/or Aromatase Inhibitors for Use in Treating Obesity and Related Symptoms | REPROS THERAPEUTICS INC (US) | 2020-01-30 | — | — | US | disclosed |