Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.39 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PDE9A | O76083 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4956947 | 0.85 | ALDH1A1 (0.52) | MEN1KMT2AALDH1A1TSHRALOX5 | |
| SCHEMBL24162242 | 0.84 | RELA (0.42) | MEN1KMT2AESR1ESR2GSTP1 | |
| SCHEMBL669208 | 0.84 | ALOX5 (0.50) | MEN1KMT2AESR1ESR2ALDH1A1 | |
| SCHEMBL5888428 | 0.83 | ESR1 (0.55) | MEN1KMT2AESR1ESR2GSTP1 | |
| SCHEMBL36279 | 0.83 | ESR1 (0.52) | ESR1ESR2GSTP1ALDH1A1TSHR | |
| SCHEMBL2379728 | 0.83 | ESR1 (0.52) | ESR1ESR2GSTP1ALDH1A1TSHR | |
| SCHEMBL29350362 | 0.83 | ESR1 (0.52) | ESR1ESR2GSTP1ALDH1A1TSHR | |
| SCHEMBL5502280 | 0.81 | ESR1 (0.53) | MEN1KMT2AESR1ESR2GSTP1 | |
| SCHEMBL6563914 | 0.81 | ALDH1A1 (0.54) | MEN1KMT2AESR1ESR2ALDH1A1 | |
| SCHEMBL30730877 | 0.81 | ESR1 (0.53) | MEN1KMT2AESR1ESR2GSTP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9478762-B2 | Organic electroluminescent device | MERCK PATENT GMBH (DE) | 2016-10-25 | — | — | US | disclosed |
| US-20130277617-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2013-10-24 | — | — | US | disclosed |
| WO-2012084114-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2012-06-28 | — | — | WO | disclosed |