Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20802973 | 1.00 | CYP17A1 (0.35) | CYP17A1CYP11B1CYP11B2HRH3ESR1 | |
| SCHEMBL20803114 | 1.00 | CYP17A1 (0.35) | CYP17A1CYP11B1CYP11B2HRH3ESR1 | |
| SCHEMBL25005767 | 0.94 | CYP11B1 (0.38) | CYP17A1CYP11B1CYP11B2ALDH1A1ATM | |
| SCHEMBL22916738 | 0.94 | CYP11B1 (0.38) | CYP17A1CYP11B1CYP11B2ALDH1A1ATM | |
| SCHEMBL14139970 | 0.94 | PRKDC (0.35) | ALDH1A1ATMGABRA1GABRG2GABRB3 | |
| SCHEMBL14139961 | 0.94 | PRKDC (0.35) | ALDH1A1ATMGABRA1GABRG2GABRB3 | |
| SCHEMBL23349018 | 0.93 | KDM1A (0.37) | CYP17A1CYP11B1CYP11B2KDM1ASLC22A12 | |
| SCHEMBL23349048 | 0.93 | KDM1A (0.37) | CYP17A1CYP11B1CYP11B2KDM1ASLC22A12 | |
| SCHEMBL14139947 | 0.91 | ALDH1A1 (0.38) | ALDH1A1ATMGABRA1GABRG2GABRB3 | |
| SCHEMBL14139948 | 0.91 | ALDH1A1 (0.38) | ALDH1A1ATMGABRA1GABRG2GABRB3 |
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-20190081249-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD (JP) | 2019-03-14 | — | — | US | disclosed |