Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.52 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.52 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.52 |
| ▸ | MME | P08473 | 3/20 | 0.49 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.47 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | LAP3 | P28838 | 2/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.38 |
| ▸ | IL1RN | P18510 | 2/20 | 0.38 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7094095 | 1.00 | CACNA2D1 (0.52) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL28877233 | 0.88 | FOLH1 (0.44) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL743997 | 0.84 | SLC1A3 (0.43) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL1650677 | 0.84 | SLC1A3 (0.43) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL276673 | 0.83 | SLC1A3 (0.50) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL5870523 | 0.81 | MME (0.56) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL307076 | 0.81 | MME (0.56) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL7262370 | 0.81 | MME (0.56) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL16141043 | 0.80 | SLC1A3 (0.41) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL9157043 | 0.80 | FOLH1 (0.46) | CACNA2D1CACNB3CACNA1CPGRADRA1A |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102964263-B | Process for preparing (+/-)-3-(Carbamoymethyl)-5-methylhexanoic acid | TAICANG QIANJING CHEMICAL CO LTD | 2014-12-03 | — | — | CN | claimed |
| CN-102964263-A | Process for preparing (+/-)-3-(Carbamoymethyl)-5-methylhexanoic acid | TAICANG QIANJING CHEMICAL CO LTD | 2013-03-13 | — | — | CN | claimed |
| CN-118684571-A | Preparation method of 3-isobutyl glutaric acid | 江西金丰药业有限公司 | 2024-09-24 | — | — | CN | disclosed |
| CN-115536524-B | Preparation method of 3-isobutyl glutaric acid | 常州大学 | 2024-05-28 | — | — | CN | disclosed |
| CN-115536524-A | Preparation method of 3-isobutyl glutaric acid | 常州大学 | 2022-12-30 | — | — | CN | disclosed |
| CN-112062689-A | Preparation method of R-3- (carbamoyl) -5-methylhexanoic acid | 太仓市茜泾化工有限公司 | 2020-12-11 | — | — | CN | disclosed |
| CN-111333529-A | Preparation method of pregabalin | 北京万全德众医药生物技术有限公司 | 2020-06-26 | — | — | CN | disclosed |
| CN-111302963-A | Method for preparing 3-aminomethyl-5-methylhexanoic acid | 合肥医工医药股份有限公司 | 2020-06-19 | — | — | CN | disclosed |
| CN-104193630-B | A kind of chemical resolution preparation method of S-configuration lyrica | CHEN HONG (CN) | 2015-09-30 | — | — | CN | disclosed |
| CN-103626668-B | Chemical resolution preparation method of S-configuration pregabalin | HEBEI IFORT FINE CHEMICAL CO LTD | 2015-05-20 | — | — | CN | disclosed |
| CN-104193630-A | Chemical resolution preparation method of S-pregabalin | DUAN XIFU | 2014-12-10 | — | — | CN | disclosed |
| CN-102964263-B | Process for preparing (+/-)-3-(Carbamoymethyl)-5-methylhexanoic acid | TAICANG QIANJING CHEMICAL CO LTD | 2014-12-03 | — | — | CN | disclosed |
| US-8852622-B2 | Coated implant composed of a biocorrodible magnesium alloy | BIOTRONIK AG (CH) | 2014-10-07 | — | — | US | disclosed |
| CN-103626668-A | Chemical resolution preparation method of S-configuration pregabalin | HEBEI IFORT FINE CHEMICAL CO LTD | 2014-03-12 | — | — | CN | disclosed |
| CN-102964263-A | Process for preparing (+/-)-3-(Carbamoymethyl)-5-methylhexanoic acid | TAICANG QIANJING CHEMICAL CO LTD | 2013-03-13 | — | — | CN | disclosed |
| US-20120078349-A1 | COATED IMPLANT COMPOSED OF A BIOCORRODIBLE MAGNESIUM ALLOY | BIOTRONIK AG (CH) | 2012-03-29 | — | — | US | disclosed |