Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.59 |
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.59 |
| ▸ | PGR | P06401 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.59 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.59 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL408521 | 0.99 | ALDH1A1 (0.58) | ALDH1A1LMNATP53CYP1A2CYP3A4 | |
| SCHEMBL8804766 | 0.92 | CYP2A6 (0.55) | ALDH1A1LMNATP53CYP1A2CYP3A4 | |
| SCHEMBL11633191 | 0.87 | CYP2A6 (0.56) | ALDH1A1LMNATP53CYP1A2CYP3A4 | |
| SCHEMBL10247118 | 0.87 | CYP11B1 (0.58) | ALDH1A1LMNATP53CYP1A2CYP3A4 | |
| SCHEMBL10927212 | 0.87 | CYP11B1 (0.53) | CYP19A1CYP11B1 | |
| SCHEMBL408358 | 0.86 | CYP19A1 (0.58) | CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL10247196 | 0.86 | AGER (0.47) | — | |
| SCHEMBL411443 | 0.86 | HMOX1 (0.57) | CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL8803353 | 0.86 | CYP19A1 (0.56) | ALDH1A1LMNATP53CYP1A2CYP3A4 | |
| SCHEMBL11633376 | 0.85 | CYP2A6 (0.61) | CYP2A6CYP19A1CYP11B1CYP11B2CYP2B6 |
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 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105218455-A | A kind of method of industrialization continuous seepage Nitric acid butoconazole | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-01-06 | — | — | CN | claimed |
| CN-105218456-A | A kind of method of suitability for industrialized production Nitric acid butoconazole | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-01-06 | — | — | CN | claimed |
| CN-105198818-A | Method for industrially producing butoconazole nitrate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-30 | — | — | CN | claimed |
| CN-105198814-A | Method for industrially producing butoconazole nitrate intermediate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-30 | — | — | CN | claimed |
| CN-105198816-A | Method for industrially producing butoconazole nitrate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-30 | — | — | CN | claimed |
| CN-105175338-A | Method for industrially producing butoconazole nitrate intermediate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-23 | — | — | CN | claimed |
| CN-105218455-B | A kind of method for industrializing continuous production Butoconazole Nitrate | 株洲千金药业股份有限公司 | 2018-07-03 | — | — | CN | disclosed |
| CN-105384600-A | Industrial production method for butoconazole nitrate intermediate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |
| CN-105218455-A | A kind of method of industrialization continuous seepage Nitric acid butoconazole | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-01-06 | — | — | CN | disclosed |
| CN-105218455-A | A kind of method of industrialization continuous seepage Nitric acid butoconazole | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-01-06 | — | — | CN | disclosed |
| CN-105218456-A | A kind of method of suitability for industrialized production Nitric acid butoconazole | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2016-01-06 | — | — | CN | disclosed |
| CN-105198818-A | Method for industrially producing butoconazole nitrate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-30 | — | — | CN | disclosed |
| CN-105198708-A | Method for industrially producing butoconazole nitrate intermediate | ZHUZHOU QIANJIN PHARMACEUTICAL CO LTD | 2015-12-30 | — | — | CN | disclosed |
| US-4518607-A | FUNGICIDES, BACXTERICIDES AND ANTIPROTOZOA AGENTS | SYNTEX (U.S.A.) INC. (US) | 1985-05-21 | — | — | US | disclosed |
| EP-0005980-B1 | DERIVATIVES OF SUBSTITUTED N-ALKYL IMIDAZOLES, THEIR PREPARATION AND THESE COMPOUNDS FOR PHARMACEUTICAL USE | SYNTEX (U.S.A.) INC. (US) | 1984-08-29 | — | — | EP | disclosed |
| US-4272545-A | FUNGICIDES, BACTERICIDE, ANTIPROTOZOA, SPERMATOCIDE | SYNTEX (U.S.A.) INC. (US) | 1981-06-09 | — | — | US | disclosed |
| US-4213991-A | BACTERICIDES, FUNGICIDES, ANTIPROTOZOA | SYNTEX (U.S.A.) INC. (US) | 1980-07-22 | — | — | US | disclosed |
| EP-0005980-A2 | Derivatives of substituted N-alkyl imidazoles, their preparation and these compounds for pharmaceutical use | SYNTEX (U.S.A.) INC. (US) | 1979-12-12 | — | — | EP | disclosed |
| US-4078071-A | FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS | SYNTEX (U.S.A.) INC. (US) | 1978-03-07 | — | — | US | disclosed |
| US-4045568-A | FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS | SYNTEX (U.S.A.) INC. (US) | 1977-08-30 | — | — | US | disclosed |