Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 3/20 | 0.46 |
| ▸ | NCK1 | P16333 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10147842 | 0.92 | CYP1A2 (0.59) | ESR1ESR2CYP1A2BACE1NCK1 | |
| SCHEMBL28176596 | 0.86 | ESR1 (0.44) | ESR1ESR2CYP1A2BACE1NCK1 | |
| SCHEMBL14184288 | 0.85 | SMN1; SMN2 (0.50) | ESR1ESR2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28264353 | 0.84 | ESR1 (0.49) | ESR1ESR2CYP1A2BACE1NCK1 | |
| SCHEMBL14184294 | 0.83 | TDP1 (0.48) | ESR1ESR2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14184246 | 0.83 | ENPP3 (0.50) | ESR1ESR2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14500755 | 0.83 | NPC1 (0.59) | ESR1ESR2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20128591 | 0.83 | ESR1 (0.47) | ESR1ESR2CYP1A2BACE1NCK1 | |
| SCHEMBL13807878 | 0.82 | ESR1 (0.41) | ESR1ESR2CYP1A2BACE1NPC1 | |
| SCHEMBL11811065 | 0.82 | CYP1A2 (0.52) | ESR1ESR2CYP1A2BACE1NCK1 |
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-8557953-B2 | Polymers comprising substituted anthracenyl units, blends comprising these polymers, and devices comprising these polymers or blends | MERCK PATENT GMBH (DE) | 2013-10-15 | — | — | US | disclosed |
| US-20120108731-A1 | POLYMERS COMPRISING SUBSTITUTED ANTHRACENYL UNITS, BLENDS COMPRISING THESE POLYMERS, AND DEVICES COMPRISING THESE POLYMERS OR BLENDS | MERCK PATENT GMBH (DE) | 2012-05-03 | — | — | US | disclosed |