Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Benzonitrile SCHEMBL27895198 | 0.90 | TSHR (0.67) | TSHRHSD17B10ALDH1A1LTA4HMAOB | |
| Benzonitrile SCHEMBL27262987 | 0.81 | TSHR (0.74) | TSHRALDH1A1MAOBCYP2A6CYP19A1 | |
| Benzonitrile SCHEMBL28874960 | 0.81 | TSHR (0.54) | TSHRHSD17B10ALDH1A1CYP2A6MAOA | |
| Benzonitrile SCHEMBL6393592 | 0.81 | TSHR (0.54) | TSHRHSD17B10LTA4HMAOBCYP2A6 | |
| Benzonitrile SCHEMBL28758173 | 0.79 | TSHR (0.52) | TSHRHSD17B10ALDH1A1CYP2A6CYP19A1 | |
| Benzonitrile SCHEMBL28327387 | 0.79 | TSHR (0.52) | TSHRHSD17B10ALDH1A1LTA4HMAOB | |
| SCHEMBL28036309 | 0.79 | CYP1A2 (0.47) | TSHRALDH1A1LTA4HMAOAHTT | |
| Benzonitrile SCHEMBL28397521 | 0.79 | TSHR (0.78) | TSHRHSD17B10ALDH1A1MAOBCYP2A6 | |
| Benzonitrile SCHEMBL11100694 | 0.79 | TSHR (0.78) | TSHRALDH1A1MAOBCYP2A6CYP19A1 | |
| Benzene SCHEMBL27948351 | 0.78 | TSHR (0.71) | TSHRALDH1A1LTA4HHTTDRD3 |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103450500-A | Novel organic ultraviolet light absorbent and preparation method thereof | CAO JIANLIN | 2013-12-18 | — | — | CN | claimed |
| CN-103232448-A | 4, 5-dihydro thiazole alcoholic ester derivative containing 4-methyl-1, 2, 3-thiadiazole and preparation method and application thereof | UNIV NANKAI | 2013-08-07 | — | — | CN | claimed |
| CN-101100461-B | Thiadiazole derivative for vulcanizing and crosslinking halogen-containing polymer and synthetic method thereof | PENGCHENG REN | 2012-04-18 | — | — | CN | claimed |
| CN-102031120-A | Fluorine-containing liquid crystal of 4-(2,3,5,6-tetrafluo-R substituent phenethyl) benzoic acid-4'-fluo-4-biphenyl ester | Shanghai tianwen chemical co ltd | 2011-04-27 | — | — | CN | claimed |
| CN-101100461-A | Thiadiazole derivative for vulcanizing and crosslinking halogen-containing polymer and synthetic method thereof | PENGCHENG REN (CN) | 2008-01-09 | — | — | CN | claimed |
| CN-106522885-A | Wax removing method for oil well in oil extraction process | 崔虹雯 | 2017-03-22 | — | — | CN | disclosed |
| CN-103450500-A | Novel organic ultraviolet light absorbent and preparation method thereof | CAO JIANLIN | 2013-12-18 | — | — | CN | disclosed |
| CN-103232448-A | 4, 5-dihydro thiazole alcoholic ester derivative containing 4-methyl-1, 2, 3-thiadiazole and preparation method and application thereof | UNIV NANKAI | 2013-08-07 | — | — | CN | disclosed |
| CN-102031120-B | Fluorine-containing liquid crystal of 4-(2,3,5,6-tetrafluo-R substituent phenethyl) benzoic acid-4'-fluo-4-biphenyl ester | Shanghai tianwen chemical co ltd | 2013-07-10 | — | — | CN | disclosed |
| CN-102711720-A | Pigmentation preventing or improving agent | POLA CHEM IND INC | 2012-10-03 | — | — | CN | disclosed |
| CN-102702136-A | Thiadiazole derivative for vulcanizing and crosslinking halogenous polymer | YANTAI HENGXIN CHEMICAL TECHNOLOGY CO LTD | 2012-10-03 | — | — | CN | disclosed |
| CN-101100461-B | Thiadiazole derivative for vulcanizing and crosslinking halogen-containing polymer and synthetic method thereof | PENGCHENG REN | 2012-04-18 | — | — | CN | disclosed |
| CN-1791647-A | Primer, resin-coated conductor foil, laminate, and method for producing laminate | HITACHI CHEMICAL CO LTD (JP) | 2006-06-21 | — | — | CN | disclosed |
| CN-1194000-C | Metallophenyl cyclopentadienyl phthalocyanine derivative, its preparation method and application | TIANJIN QINGMAI INFORMATION MA (CN) | 2005-03-23 | — | — | CN | disclosed |
| CN-1551870-A | heterocyclic amide derivatives and their use as pesticides | 拜尔农作物科学股份公司 | 2004-12-01 | — | — | CN | disclosed |
| CN-1435411-A | Process for preparing N.N'-diacyl-N'-t-butyl hydrazine | ZHELUSE TECH CO LTD ZHUHAI (CN) | 2003-08-13 | — | — | CN | disclosed |
| CN-1394864-A | Metallophenyl cyclopentadienyl phthalocyanine derivative, its preparation method and application | TIANJIN QINGMAI INFORMATION MA (CN) | 2003-02-05 | — | — | CN | disclosed |
| CN-1052482-C | Camptothecin derivatives, preparations thereof and antitumor agents | YAKULT HONSHA KK (JP) | 2000-05-17 | — | — | CN | disclosed |
| CN-1126212-A | Camptothecin derivatives, preparations thereof and antitumor agents | YAKULT HONSHA KK (JP) | 1996-07-10 | — | — | CN | disclosed |
| CN-1078722-A | Fungicidal thiadiazines | DU PONT (US) | 1993-11-24 | — | — | CN | disclosed |