Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.95 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.58 |
| ▸ | GSK3B | P49841 | 1/20 | 0.56 |
| ▸ | TYMS | P04818 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | CASP7 | P55210 | 4/20 | 0.52 |
| ▸ | CASP1 | P29466 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | RGS12 | O14924 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29255681 | 1.00 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL57038 | 0.98 | PARP1 (1.00) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL2487811 | 0.98 | PARP1 (1.00) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL29038783 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL29157626 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| Hydrochloric Acid SCHEMBL5270956 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL28640108 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL29038784 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL9413391 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE | |
| SCHEMBL28216743 | 0.95 | PARP1 (0.95) | PARP1NPSR1ALDH1A1CES2BCHE |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4824962-A | Process for the preparation of naphthostyril | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-04-25 | — | — | US | claimed |
| CN-116715665-A | Organic nano electrode material for sodium ion battery and preparation method and application thereof | 陕西师范大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-107033876-B | Preparation method of organic-inorganic fluorescent composite material | 巢湖学院 | 2020-01-10 | — | — | CN | disclosed |
| CN-105367403-B | Prepare the method and system of cyclohexanone | 埃克森美孚化学专利公司 | 2018-02-06 | — | — | CN | disclosed |
| CN-105367397-B | Prepare the method and system of cyclohexanone | 埃克森美孚化学专利公司 | 2017-07-21 | — | — | CN | disclosed |
| CN-105837505-A | Water or oil soluble controllable fluorescent monomer for copolymerization and preparation method thereof | 上海大学 | 2016-08-10 | — | — | CN | disclosed |
| CN-103819500-A | Alkoxy silane with high refractive index and silicon resin thereof | UNIV WUHAN | 2014-05-28 | — | — | CN | disclosed |
| US-5102510-A | Electrolytic removal of halogenated compounds in presence of electrolyte-organic solvent, soluble electroconductive salts and a soluble electron transfer compound | ENSR CORPORATION (US) | 1992-04-07 | — | — | US | disclosed |
| EP-0474014-A1 | Process for electrochemical dehalogenation of organic contaminants | ENSR CORPORATION (US) | 1992-03-11 | — | — | EP | disclosed |
| US-4824962-A | Process for the preparation of naphthostyril | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-04-25 | — | — | US | disclosed |
| US-4824962-A | Process for the preparation of naphthostyril | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-04-25 | — | — | US | disclosed |
| US-4775450-A | USING AN IMINIUM COMPOUND | TRACER TECHNOLOGIES, INC. (US) | 1988-10-04 | — | — | US | disclosed |
| US-4707230-A | ELECTROLYSIS USING IMINIUM ION | TRACER TECHNOLOGIES, INC. (US) | 1987-11-17 | — | — | US | disclosed |
| EP-0226275-A1 | Electrochemical dehalogenation of organic compounds | Tracer Technologies, Inc. (US) | 1987-06-24 | — | — | EP | disclosed |
| US-4614803-A | Process for the preparation of dry alkali metal salts of 1,8-naphthalimide | HOECHST AKTIENGESELLSCHAFT (DE) | 1986-09-30 | — | — | US | disclosed |
| US-4180579-A | 2-Substituted-1H-benz[de]-isoquinoline-1,3(2H)-diones | E. R. SQUIBB & SONS, INC. (US) | 1979-12-25 | — | — | US | disclosed |
| US-4170651-A | ANTIINFLAMMATORY AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1979-10-09 | — | — | US | disclosed |
| US-4115555-A | ANTIINFLAMMATORY | E. R. SQUIBB & SONS, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4051246-A | ANTIINFLAMMATORY | E. R. SQUIBB & SONS, INC. (US) | 1977-09-27 | — | — | US | disclosed |