Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.71 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 0.61 |
| ▸ | NQO2 | P16083 | 2/20 | 0.60 |
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA7 | P43166 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6799049 | 1.00 | ESR1 (0.71) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL6799046 | 1.00 | ESR1 (0.71) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL10413988 | 0.94 | ALDH1A1 (0.67) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL13485342 | 0.94 | ALDH1A1 (0.67) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL6806549 | 0.87 | NQO2 (0.65) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL14023145 | 0.87 | ALDH1A1 (0.60) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL6806552 | 0.87 | NQO2 (0.65) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL6806547 | 0.87 | NQO2 (0.65) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL4900604 | 0.87 | ALDH1A1 (0.66) | ESR1ESR2ALDH1A1MAPTKDM4E | |
| SCHEMBL4900601 | 0.87 | ALDH1A1 (0.66) | ESR1ESR2ALDH1A1MAPTKDM4E |
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-6762205-B1 | STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 2004-07-13 | — | — | US | disclosed |
| EP-1193250-A1 | PHENYL SULFAMATE DERIVATIVES | Teikoku Hormone Mfg. Co., Ltd. (JP) | 2002-04-03 | — | — | EP | disclosed |