Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 10/20 | 0.37 |
| ▸ | STS | P08842 | 9/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16879722 | 0.86 | GABRA1 (0.32) | CYP19A1STSGABRA1GABRG2GABRB3 | |
| SCHEMBL16879688 | 0.82 | CYP19A1 (0.59) | CYP19A1STS | |
| SCHEMBL16879949 | 0.81 | CNR1 (0.36) | CYP19A1STSPPARGALDH1A1CYP1A2 | |
| SCHEMBL16879495 | 0.81 | CYP19A1 (0.35) | CYP19A1STSGABRA1GABRG2GABRB3 | |
| SCHEMBL16879851 | 0.81 | JAK2 (0.35) | CYP19A1ALDH1A1CYP1A2CYP3A4HPGD | |
| SCHEMBL16879840 | 0.80 | CYP19A1 (0.35) | CYP19A1STSGABRA1GABRG2GABRB3 | |
| SCHEMBL16879616 | 0.80 | STS (0.35) | CYP19A1STSALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL16879535 | 0.79 | AR (0.37) | CYP19A1STSGABRA1GABRG2GABRB3 | |
| SCHEMBL16879967 | 0.77 | ADORA2A (0.41) | ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL16880153 | 0.75 | CYP19A1 (0.45) | CYP19A1STS |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3089966-A1 | NEW SUBSTITUTED BIPHENYL ANALOGUES AS DUAL INHIBITORS OF AROMATASE AND SULFATASE | Beaufour Ipsen Tianjin Pharmaceutical Co., Ltd (CN) | 2016-11-09 | — | — | EP | disclosed |
| WO-2015100609-A1 | NEW SUBSTITUTED BIPHENYL ANALOGUES AS DUAL INHIBITORS OF AROMATASE AND SULFATASE | BEAUFOUR IPSEN TIANJIN PHARMACEUTICAL CO., LTD (CN) | 2015-07-09 | — | — | WO | disclosed |