Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 13/20 | 0.45 |
| ▸ | ESR1 | P03372 | 13/20 | 0.45 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | ESRRB | O95718 | 1/20 | 0.40 |
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL662597 | 0.82 | MIF (0.53) | ESR2ESR1MIFESRRBESRRA | |
| SCHEMBL1647149 | 0.77 | ERN1 (0.52) | ESR2ESR1MIF | |
| SCHEMBL30152425 | 0.76 | EGFR (0.47) | ESR2ESR1 | |
| SCHEMBL71628 | 0.76 | EGFR (0.47) | ESR2ESR1 | |
| SCHEMBL491580 | 0.76 | NFE2L2 (0.54) | NFE2L2CA3CA6CA5ACA9 | |
| SCHEMBL29442889 | 0.76 | NFE2L2 (0.54) | NFE2L2CA3CA6CA5ACA9 | |
| SCHEMBL16961910 | 0.74 | NFE2L2 (0.39) | NFE2L2 | |
| SCHEMBL29700768 | 0.74 | NFE2L2 (0.39) | NFE2L2 | |
| SCHEMBL24885801 | 0.74 | LMNA (0.39) | ESR2ESR1MIFNFE2L2TTR | |
| SCHEMBL30078241 | 0.74 | LMNA (0.39) | ESR2ESR1MIFNFE2L2TTR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180022996-A1 | BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2018-01-25 | — | — | US | disclosed |
| US-20180022996-A1 | BIMESOGENIC COMPOUNDS AND MESOGENIC MEDIA | MERCK PATENT GMBH (DE) | 2018-01-25 | — | — | US | disclosed |
| CN-103889230-B | Active agent combinations | 拜耳知识产权有限责任公司 | 2016-06-15 | — | — | CN | disclosed |
| CN-103889230-A | Active compound combinations | BAYER IP GMBH | 2014-06-25 | — | — | CN | disclosed |
| CN-103827112-A | Piperidine pyrazoles as fungicides | BAYER IP GMBH | 2014-05-28 | — | — | CN | disclosed |