Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22159396 | 0.88 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL7956909 | 0.81 | CYP2A6 (0.40) | CYP2A6HTR2ACTSKESR1ESR2 | |
| SCHEMBL10578908 | 0.79 | IDO1 (0.38) | ESR1ESR2CA1CA2CA9 | |
| SCHEMBL3130888 | 0.77 | TSHR (0.48) | CYP2A6ESR1ESR2 | |
| SCHEMBL10821953 | 0.77 | ESR1 (0.32) | ESR1ESR2 | |
| SCHEMBL320072 | 0.77 | ESR1 (0.54) | ESR1ESR2CA1CA2CA5A | |
| SCHEMBL28507546 | 0.77 | CHRNA7 (0.38) | ESR1ESR2CA1CA2CA5A | |
| SCHEMBL8462292 | 0.77 | ESR1 (0.54) | ESR1ESR2CA1CA2CA5A | |
| SCHEMBL323076 | 0.77 | ALDH1A1 (0.37) | ESR1ESR2 | |
| SCHEMBL7870015 | 0.76 | POLB (0.39) | HTR2A |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117402106-A | Multidentate organic ligand containing triphenylamine-terpyridine structure, metal supermolecular polymer, polymer film and preparation method | 吉林大学 | 2024-01-16 | — | — | CN | disclosed |
| CN-111747900-B | Novel electron transmission material | 烟台盛华液晶材料有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-110494531-B | Luminescent material, compound, and organic light-emitting element | 国立大学法人九州大学 | 2023-05-12 | — | — | CN | disclosed |
| CN-113651838-B | Compound containing multiple boron-oxygen family atom hybrid fused ring units and preparation method and application thereof | 中国科学院长春应用化学研究所 | 2023-03-24 | — | — | CN | disclosed |
| CN-113651838-A | Compound containing multiple boron-oxygen family atom hybrid fused ring units and preparation method and application thereof | 中国科学院长春应用化学研究所 | 2021-11-16 | — | — | CN | disclosed |
| CN-111747900-A | Novel electronic transmission material | 烟台盛华液晶材料有限公司 | 2020-10-09 | — | — | CN | disclosed |
| CN-110494531-A | Luminescent material, compound and organic illuminating element | UNIV KYUSHU | 2019-11-22 | — | — | CN | disclosed |
| EP-1245554-B1 | Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same | JSR CORP (JP) | 2005-01-26 | — | — | EP | disclosed |
| US-6271248-B1 | USED IN TREATING HYPERTENSION, PULMONARY HYPERTENSION, RENAL/ GLOMERULAR/MESANGIAL CELL DISORDERS, ENDOTOXEMIA, ISCHEMIA, TUMOR GROWTH, ATHERSCLEROSIS, RESTENOSIS, SUBARACHNOID HEMORRHAGE, PROSTATIC HYPERTROPHY, CONGESTIVE HEART FAILURE | BRISTOL-MYERS SQUIBB COMPANY | 2001-08-07 | — | — | US | disclosed |
| US-6080774-A | Substituted biphenylsulfonamide endothelin antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-06-27 | — | — | US | disclosed |
| EP-0768305-A1 | N-Isoxazolyl-biphenylsulfonamide derivatives, their preparation and their use as endothelin antagonists | BRISTOL-MYERS SQUIBB COMPANY (US) | 1997-04-16 | — | — | EP | disclosed |
| US-4866156-A | Poly(arylether) or poly(arylthioether) from 2,2-bis(fluorophenyl)-hexafluoropropane | HUGHES AIRCRAFT COPMANY (US) | 1989-09-12 | — | — | US | disclosed |