Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | TACR2 | P21452 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SHBG | P04278 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TST | Q16762 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16722721 | 0.89 | ESR1 (0.43) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL23519530 | 0.87 | HTR1A (0.43) | HTR2CHTR2ASIGMAR1LPLLIPG | |
| SCHEMBL31351356 | 0.79 | PTGS2 (0.52) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL29242122 | 0.79 | PTGS2 (0.52) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL27610237 | 0.75 | DRD2 (0.46) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL27610259 | 0.75 | SMN1; SMN2 (0.44) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL27091898 | 0.74 | SLC6A2 (0.46) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL20846119 | 0.73 | SMN1; SMN2 (0.43) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL565857 | 0.73 | DRD2 (0.45) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL24037195 | 0.71 | PTGS2 (0.47) | ESR1ADRA2AADORA3TACR2SLC6A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9517240-B2 | Methods and compositions for cancer prevention and treatment | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2016-12-13 | — | — | US | disclosed |
| US-20130331365-A1 | METHODS AND COMPOSITIONS FOR CANCER PREVENTION AND TREATMENT | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2013-12-12 | — | — | US | disclosed |
| US-20100160275-A1 | METHODS AND COMPOSITIONS FOR CANCER PREVENTION AND TREATMENT | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2010-06-24 | — | — | US | disclosed |
| WO-2008039482-A2 | METHODS AND COMPOSITIONS FOR CANCER PREVENTION AND TREATMENT | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2008-04-03 | — | — | WO | disclosed |