Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 4/20 | 0.39 |
| ▸ | ACP3 | P15309 | 2/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14219367 | 1.00 | CYP17A1 (0.42) | CYP17A1ESR1ESR2CYP3A4CYP19A1 | |
| SCHEMBL14219431 | 0.88 | PDPK1 (0.40) | CYP17A1ESR1ESR2CYP11B1CYP11B2 | |
| SCHEMBL14219290 | 0.85 | ANPEP (0.39) | ESR1ESR2ACP3LMNAADRB1 | |
| SCHEMBL14219291 | 0.85 | PPARG (0.39) | ESR1ESR2ACP3ADRB1ADRB3 | |
| SCHEMBL14219365 | 0.83 | ACP3 (0.37) | ESR1ESR2ACP3LMNAADRB1 | |
| SCHEMBL14219953 | 0.81 | SIGMAR1 (0.34) | ESR1ESR2CYP19A1ACP3ADRB1 | |
| SCHEMBL14219419 | 0.81 | SIGMAR1 (0.34) | ESR1ESR2CYP19A1ACP3ADRB1 | |
| SCHEMBL14219363 | 0.80 | CNR1 (0.38) | ESR1ESR2CYP11B1CYP11B2ACP3 | |
| SCHEMBL14219550 | 0.80 | CNR1 (0.38) | ESR1ESR2CYP11B1CYP11B2ACP3 | |
| SCHEMBL14219296 | 0.80 | SIGMAR1 (0.35) | ESR1ESR2ACP3ADRB1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1650285-B1 | Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element | SEIMI CHEM KK (JP) | 2008-04-30 | — | — | EP | disclosed |