Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | TACR2 | P21452 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SHBG | P04278 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6237288 | 0.88 | ESR1 (0.52) | ESR1ESR2CALM1ADRA2ASLC6A2 | |
| SCHEMBL19143127 | 0.85 | LMNA (0.37) | LMNAAKR1B10AKR1B1CA2MET | |
| SCHEMBL5539415 | 0.81 | MAOB (0.48) | ALDH1A1LMNACYP3A4 | |
| SCHEMBL11004564 | 0.81 | KCNH2 (0.45) | KDM4EALDH1A1LMNACHRM2IGF1R | |
| SCHEMBL12215720 | 0.80 | CA1 (0.53) | KDM4ECA2MGLLCA1 | |
| SCHEMBL27373 | 0.80 | IDO1 (0.55) | SLC6A3LMNA | |
| SCHEMBL5542777 | 0.78 | FFAR1 (0.46) | LMNAPTGS1MGLL | |
| Ethoxycarbonyl Group SCHEMBL27880803 | 0.78 | ESR1 (0.47) | ESR1ESR2CALM1ADRA2ASLC6A2 | |
| SCHEMBL6510439 | 0.78 | CALM1 (0.53) | CALM1IGF1RALOX15TAAR1L3MBTL1 | |
| SCHEMBL437438 | 0.77 | IDO1 (0.50) | ESR1ESR2CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103459400-B | Mi Zuo Bing oxazine compounds or its salt | TAIHO PHARMACEUTICAL CO.,LTD. (JP) | 2016-05-18 | — | — | CN | disclosed |
| CN-103120759-B | Buddha's hand is joined plain supercritical extraction method | HUANG YUNHU (CN) | 2016-05-04 | — | — | CN | disclosed |