Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL28200874 | 0.90 | KDM4E (0.50) | ALDH1A1TSHRGLAMEN1KMT2A | |
| SCHEMBL9137734 | 0.86 | GAA (0.40) | ALDH1A1TSHRGLAMEN1KMT2A | |
| SCHEMBL8649205 | 0.83 | TSHR (0.39) | ALDH1A1TSHRGLAMEN1KMT2A | |
| SCHEMBL10388833 | 0.83 | ALDH1A1 (0.42) | ALDH1A1TSHRGLAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8619257 | 0.81 | TSHR (0.38) | ALDH1A1TSHRGLAMEN1KMT2A | |
| SCHEMBL16614019 | 0.81 | TSHR (0.52) | ALDH1A1TSHRKDM4ETDP1ALOX12 | |
| SCHEMBL5137015 | 0.80 | CHRM5 (0.44) | ALDH1A1KMT2AKDM4ESLC6A2MAPT | |
| SCHEMBL4823355 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TSHRGLAMEN1KMT2A | |
| SCHEMBL28347957 | 0.79 | TDP1 (0.41) | ALDH1A1MEN1KMT2ATDP1CHRM2 | |
| SCHEMBL8978987 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRGLAMEN1KMT2A |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108264488-A | A kind of preparation method for replacing phthalazone class compound | 天津瑞岭化工有限公司 | 2018-07-10 | — | — | CN | claimed |
| CN-109796494-B | A method of recycling L-fosfomycin dextrorotation phenyl ethylamine salt industrial Phosphorus From Wastewater resource and organic matter | 南京道尔医药科技有限公司 | 2019-09-13 | — | — | CN | disclosed |
| CN-109796494-A | A method of recycling L-fosfomycin dextrorotation phenyl ethylamine salt industrial Phosphorus From Wastewater resource and organic matter | 南京道尔医药科技有限公司 | 2019-05-24 | — | — | CN | disclosed |
| CN-108264488-A | A kind of preparation method for replacing phthalazone class compound | 天津瑞岭化工有限公司 | 2018-07-10 | — | — | CN | disclosed |
| US-6235936-B1 | TRANSITION METAL CATALYST FOR ARYLATION | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2001-05-22 | — | — | US | disclosed |
| EP-1058678-A2 | METAL-CATALYZED ARYLATIONS AND VINYLATIONS OF HYDRAZINES, HYDRAZONES, HYDROXYLAMINES AND OXIMES | Massachusetts Institute of Technology (US) | 2000-12-13 | — | — | EP | disclosed |
| WO-1999043643-A2 | METAL-CATALYZED ARYLATIONS AND VINYLATIONS OF HYDRAZINES, HYDRAZONES, HYDROXYLAMINES AND OXIMES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1999-09-02 | — | — | WO | disclosed |
| US-5672793-A | NONFOULING, DISCOLORATION INHIBITION | PHILLIPS PETROLEUM COMPANY (US) | 1997-09-30 | — | — | US | disclosed |
| WO-1995002848-A1 | MULTIFUNCTIONAL AZO COMPOUNDS AND POLYMERS DERIVED THEREFROM FOR NONLINEAR OPTICS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-01-26 | — | — | WO | disclosed |