Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | GPR3 | P46089 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23515515 | 0.84 | ESR1 (0.45) | ESR1ESR2MIFGPR3MEN1 | |
| SCHEMBL23515512 | 0.79 | ESR1 (0.38) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL13679292 | 0.78 | GPR3 (0.40) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL15146693 | 0.78 | GPR3 (0.40) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL26361785 | 0.78 | GPR3 (0.40) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL20365633 | 0.78 | GPR3 (0.40) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL23515603 | 0.76 | ESR1 (0.36) | ESR1ESR2GPR3MAPT | |
| SCHEMBL8636862 | 0.75 | GPR3 (0.56) | GPR3MEN1KMT2AGAAMAPT | |
| SCHEMBL1104963 | 0.75 | GPR3 (0.37) | ESR1ESR2GPR3MEN1KMT2A | |
| SCHEMBL13679365 | 0.75 | GPR3 (0.37) | ESR1ESR2GPR3MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1445769-A1 | Optical layers comprising dyes based on 3-dicyanomethylidene-2,3-dihydrothiophen-1,1-dioxide derivatives | CLARIANT INTERNATIONAL LTD. (CH) | 2004-08-11 | — | — | EP | disclosed |