Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | LPL | P06858 | 1/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.41 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17264039 | 0.93 | ESR1 (0.42) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL14490054 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL14490069 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL7596411 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL18079876 | 0.93 | ALDH1A1 (0.45) | ESR1ESR2GSTP1ALDH1A1CYP1A2 | |
| SCHEMBL7592498 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL7596428 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL14490061 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL3662589 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 | |
| SCHEMBL17366400 | 0.93 | ESR1 (0.55) | ESR1ESR2ALOX5CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20140138633-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2014-05-22 | — | — | US | disclosed |
| US-20140138633-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2014-05-22 | — | — | US | disclosed |