Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.67 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3811364 | 0.90 | ESR2 (0.80) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL7530533 | 0.90 | ESR2 (0.80) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL9838333 | 0.83 | ESR2 (0.95) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL19428169 | 0.83 | ESR2 (0.70) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL7183973 | 0.81 | ESR2 (0.55) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL30738223 | 0.81 | ESR1 (0.67) | ESR1ESR2MAPTMEN1KMT2A | |
| SCHEMBL120895 | 0.80 | ESR2 (1.00) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL10515534 | 0.80 | ESR2 (0.65) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL8411084 | 0.80 | ESR2 (0.90) | ESR1ESR2LMNACYP3A4MAPT | |
| SCHEMBL870311 | 0.80 | ESR2 (0.90) | ESR1ESR2LMNACYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000109442-A | LABELED BISPHENOL A COMPOUND | SUMIKA CHEMICAL ANALYSIS SERVICE LTD | 2000-04-18 | — | — | JP | disclosed |