Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.38 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.36 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.36 |
| ▸ | PTGES | O14684 | 3/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL22435740 | 0.97 | HSD17B1 (0.39) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22435755 | 0.96 | ESR1 (0.37) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22435607 | 0.95 | ESR1 (0.44) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22435737 | 0.94 | ESR1 (0.36) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22435739 | 0.94 | GSTP1 (0.38) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22436017 | 0.94 | ESR1 (0.43) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL24814643 | 0.93 | HSD17B1 (0.41) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22435606 | 0.92 | HSD17B1 (0.44) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL21141149 | 0.91 | MEN1 (0.44) | ESR1ESR2HSD17B1HSD17B2ACMSD | |
| SCHEMBL22436003 | 0.91 | HSD17B1 (0.42) | ESR1ESR2HSD17B1HSD17B2ACMSD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020185054-A9 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 (KR) | 2020-11-26 | — | — | WO | disclosed |
| WO-2020185054-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2020-09-17 | — | — | WO | disclosed |