Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.41 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CPA1 | P15085 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7252952 | 0.87 | EPHX1 (0.55) | EPHX1TSHRTRPA1ALDH1A1TAAR1 | |
| Hydrogen Sulfide SCHEMBL9623454 | 0.84 | EPHX1 (0.52) | EPHX1TSHRTRPA1ALDH1A1TAAR1 | |
| SCHEMBL6682088 | 0.81 | TDP1 (0.46) | EPHX1TSHRTRPA1ALDH1A1TAAR1 | |
| SCHEMBL1552921 | 0.78 | TRPA1 (0.54) | EPHX1TSHRTRPA1TAAR1SLC6A2 | |
| SCHEMBL12708159 | 0.78 | TRPA1 (0.54) | EPHX1TSHRTRPA1TAAR1SLC6A2 | |
| SCHEMBL10457665 | 0.78 | EPHX1 (0.46) | EPHX1TSHRTRPA1ALDH1A1TAAR1 | |
| SCHEMBL17422269 | 0.78 | EPHX1 (0.52) | EPHX1TAAR1SLC6A2SIGMAR1MAOA | |
| SCHEMBL2243355 | 0.78 | TRPA1 (0.50) | EPHX1TRPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL1975377 | 0.78 | TRPA1 (0.50) | EPHX1TRPA1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL5980780 | 0.78 | EPHX1 (0.46) | EPHX1TSHRTRPA1ALDH1A1TAAR1 |
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-114805044-A | Novel method for synthesizing dibromo compound | 兰州大学 | 2022-07-29 | — | — | CN | disclosed |
| CN-109803992-B | Isocyanate composition and method for producing isocyanate polymer | 旭化成株式会社 | 2022-05-24 | — | — | CN | disclosed |
| CN-109843963-B | Isocyanate composition, method for producing isocyanate polymer, and isocyanate polymer | 旭化成株式会社 | 2022-05-13 | — | — | CN | disclosed |
| CN-105130923-A | Preparation method of polysubstituted 2-iminothiazole compound | UNIV ZHEJIANG TECHNOLOGY | 2015-12-09 | — | — | CN | disclosed |
| EP-0985649-B1 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES (JP) | 2004-11-24 | — | — | EP | disclosed |
| US-6462248-B1 | THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS | TORAY INDUSTRIES, INC. (JP) | 2002-10-08 | — | — | US | disclosed |
| EP-0985649-A2 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES, INC. (JP) | 2000-03-15 | — | — | EP | disclosed |
| US-5998674-A | BROMINATING AN UNSATURATED BOND; HEAT GENERATED BY REACTION IS USED TO VAPORIZE SOLVENT | TEIJIN CHEMICALS, LTD. (JP) | 1999-12-07 | — | — | US | disclosed |
| EP-0899254-A2 | Bromine compound production method | Teijin Chemicals, Ltd. (JP) | 1999-03-03 | — | — | EP | disclosed |
| US-5395827-A | Analgesic, anticonvulsant, antiepileptic and anxiolytic agents | GUILFORD PHARMACEUTICALS INC. (US) | 1995-03-07 | — | — | US | disclosed |
| US-5243116-A | Acidic mordenite zeolite catalyst | THE DOW CHEMICAL COMPANY (US) | 1993-09-07 | — | — | US | disclosed |
| WO-1993005772-A1 | φ-[2-(PHOSPHONOALKYL)PHENYL]-2-AMINOALKANOIC ACIDS AS ANTAGONISTS OF EXCITATORY AMINO ACID RECEPTORS | NOVA PHARMACEUTICAL CORPORATION (US) | 1993-04-01 | — | — | WO | disclosed |
| US-5198595-A | Acidic Mordenite Zeolite Catalyst | THE DOW CHEMICAL COMPANY (US) | 1993-03-30 | — | — | US | disclosed |
| EP-0345478-A1 | Process for the production of chloromethyl phenethyl bromide | Bromine Compounds Ltd. (IL) | 1989-12-13 | — | — | EP | disclosed |
| US-3960858-A | 3-Hetero acyl-2,3-benzoxazepines | GRUPPO LEPETIT S.P.A. (IT) | 1976-06-01 | — | — | US | disclosed |