Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PTPRB | P23467 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4901424 | 0.83 | ALDH1A1 (0.38) | TSHRALDH1A1PKMKDM4ETHRB | |
| SCHEMBL28274074 | 0.80 | LMNA (0.33) | PKMTHRBMEN1KMT2APTPRB | |
| SCHEMBL12565586 | 0.75 | DGAT1 (0.35) | TSHRALDH1A1PKM | |
| SCHEMBL809243 | 0.75 | DGAT1 (0.40) | TSHRALDH1A1PKMKDM4EMEN1 | |
| SCHEMBL1691335 | 0.74 | DGAT1 (0.38) | TSHRALDH1A1PKMKDM4ETHRB | |
| SCHEMBL17652959 | 0.73 | HMGCR (0.34) | TSHRALDH1A1KDM4EPTPRBLMNA | |
| SCHEMBL29674742 | 0.73 | DGAT1 (0.39) | TSHRALDH1A1PKMKDM4EMEN1 | |
| SCHEMBL9723233 | 0.72 | ALDH1A1 (0.33) | ALDH1A1PKMKDM4ETHRBMEN1 | |
| SCHEMBL29693811 | 0.72 | CYP1A2 (0.33) | — | |
| SCHEMBL28132221 | 0.72 | MMP8 (0.40) | ALDH1A1 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102558042-B | 4-bromine-6-methylnicotinicacid and preparation method thereof | KANG AUKE PHARMA CO LTD | 2014-02-12 | — | — | CN | claimed |
| CN-103373976-A | Refining method of armillarisin | LAN YACHAO | 2013-10-30 | — | — | CN | claimed |
| CN-102786489-A | Preparation method of 5-methyl isoxazole-4-ethyl formate | UNIV DALIAN TECH | 2012-11-21 | — | — | CN | claimed |
| CN-102558042-A | 4-bromine-6-methylnicotinicacid and preparation method thereof | KANG AUKE PHARMA CO LTD | 2012-07-11 | — | — | CN | claimed |
| CN-107793411-A | Compound of isobioquin group and the application as antiviral drugs | 银杏树药业(苏州)有限公司 | 2018-03-13 | — | — | CN | disclosed |
| CN-104418800-B | Aryl pyrrole (phonetic) pyridine class compound and application thereof | 沈阳中化农药化工研发有限公司 | 2017-06-16 | — | — | CN | disclosed |
| CN-102406634-B | Hiv-1 integrase inhibitor | INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2015-09-30 | — | — | CN | disclosed |
| CN-104418800-A | Aryl pyridine/pyrimidine compound and application thereof | SINOCHEM CORP | 2015-03-18 | — | — | CN | disclosed |
| CN-101817798-B | Novel environment-friendly process for preparing leflunomide | JIANGSU YABANG AIPUSEN PHARMACEUTICAL CO LTD | 2014-04-16 | — | — | CN | disclosed |
| CN-102558042-B | 4-bromine-6-methylnicotinicacid and preparation method thereof | KANG AUKE PHARMA CO LTD | 2014-02-12 | — | — | CN | disclosed |
| CN-103373976-A | Refining method of armillarisin | LAN YACHAO | 2013-10-30 | — | — | CN | disclosed |
| CN-102786489-A | Preparation method of 5-methyl isoxazole-4-ethyl formate | UNIV DALIAN TECH | 2012-11-21 | — | — | CN | disclosed |
| CN-102558042-A | 4-bromine-6-methylnicotinicacid and preparation method thereof | KANG AUKE PHARMA CO LTD | 2012-07-11 | — | — | CN | disclosed |
| CN-102406634-A | HIV-1 integrase inhibitors | INST OF MEDICINAL BIOTECHNOLOGY ACADEMY OF MEDICAL SCIENCES | 2012-04-11 | — | — | CN | disclosed |
| CN-101817798-A | Novel environment-friendly process for preparing leflunomide | CHANGZHOU CITY YABANG PHARMACEUTICAL RES INST CO LTD | 2010-09-01 | — | — | CN | disclosed |