| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L055301
BDB055301
|
Dibenzo(b,e)(1,4)dioxin, 2,3-dibromo-7,8-dichloro-
Clc1cc2c(cc1Cl)Oc1cc(Br)c(Br)cc1O2
|
C12H4Br2Cl2O2 410.876000 |
SBSJXPIUKNBZND-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408320; PubChem:CID39728
|
Local ready
Direct docking supported
|
|
E3L055302
BDB055302
|
2,8-Dichlorodibenzo-p-dioxin
Clc1ccc2c(c1)Oc1cc(Cl)ccc1O2
|
C12H6Cl2O2 253.084000 |
WMWJCKBJUQDYLM-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408321; PubChem:CID38193
|
Local ready
Direct docking supported
|
|
E3L055303
BDB055303
|
1,3,7,9-Tetrabromodibenzo-p-dioxin
Brc1cc(Br)c2c(c1)Oc1cc(Br)cc(Br)c1O2
|
C12H4Br4O2 499.778000 |
XQDUOAUBGVDINZ-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408322; PubChem:CID86291
|
Local ready
Direct docking supported
|
|
E3L055304
BDB055304
|
2,3,4,5-Tetrachlorobiphenyl
Clc1cc(-c2ccccc2)c(Cl)c(Cl)c1Cl
|
C12H6Cl4 291.992000 |
HLQDGCWIOSOMDP-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408324; PubChem:CID36401
|
Local ready
Direct docking supported
|
|
E3L055305
BDB055305
|
1-Chlorodibenzo-P-dioxin
Clc1cccc2c1Oc1ccccc1O2
|
C12H7ClO2 218.639000 |
VGGGRWRBGXENKI-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408327; PubChem:CID37207
|
Local ready
Direct docking supported
|
|
E3L055306
BDB055306
|
2-Chlorodibenzofuran
Clc1ccc2oc3ccccc3c2c1
|
C12H7ClO 202.640000 |
PRKTYWJFCODJOA-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408328; PubChem:CID32781
|
Local ready
Direct docking supported
|
|
E3L055307
BDB055307
|
1,3,6,7,8-Pentachlorodibenzofuran
Clc1cc(Cl)c2c(c1)oc1c(Cl)c(Cl)c(Cl)cc12
|
C12H3Cl5O 340.420000 |
FRLMQDUYUJIHCZ-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408329; PubChem:CID51126
|
Local ready
Direct docking supported
|
|
E3L055308
BDB055308
|
Pcb 105
Clc1ccc(-c2ccc(Cl)c(Cl)c2Cl)cc1Cl
|
C12H5Cl5 326.437000 |
WIDHRBRBACOVOY-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408330; PubChem:CID36188
|
Local ready
Direct docking supported
|
|
E3L055309
BDB055309
|
1,3,4,7,8-Pentachlorodibenzofuran
Clc1cc2oc3c(Cl)c(Cl)cc(Cl)c3c2cc1Cl
|
C12H3Cl5O 340.420000 |
ORSUQGVCWLXKLZ-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408331; PubChem:CID42840
|
Local ready
Direct docking supported
|
|
E3L055310
BDB055310
|
1,2,3,6,7,8-Hexachlorodibenzofuran
Clc1cc2c(oc3cc(Cl)c(Cl)c(Cl)c32)c(Cl)c1Cl
|
C12H2Cl6O 374.865000 |
JEYJJJXOFWNEHN-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408332; PubChem:CID42140
|
Local ready
Direct docking supported
|
|
E3L055311
BDB055311
|
1,2,3,4,8-Pentachlorodibenzofuran
Clc1ccc2oc3c(Cl)c(Cl)c(Cl)c(Cl)c3c2c1
|
C12H3Cl5O 340.420000 |
ZCTNDJSCLPJCRA-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408333; PubChem:CID49923
|
Local ready
Direct docking supported
|
|
E3L055312
BDB055312
|
2,7-Dibromodibenzo-P-dioxin
Brc1ccc2c(c1)Oc1ccc(Br)cc1O2
|
C12H6Br2O2 341.986000 |
FPZRQZSGNKQNMF-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408334; PubChem:CID38213
|
Local ready
Direct docking supported
|
|
E3L055313
BDB055313
|
1,2,4-Trichlorodibenzo(b,e)(1,4)dioxin
Clc1cc(Cl)c2c(c1Cl)Oc1ccccc1O2
|
C12H5Cl3O2 287.529000 |
HRVUKLBFRPWXPJ-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408335; PubChem:CID38253
|
Local ready
Direct docking supported
|
|
E3L055314
BDB055314
|
1,2,4,8-Tetrachlorodibenzofuran
Clc1ccc2oc3c(Cl)cc(Cl)c(Cl)c3c2c1
|
C12H4Cl4O 305.975000 |
BFTASCFRRBHFFK-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408336; PubChem:CID47300
|
Local ready
Direct docking supported
|
|
E3L055315
BDB055315
|
2,3,4,8-Tetrachlorodibenzofuran
Clc1ccc2oc3c(Cl)c(Cl)c(Cl)cc3c2c1
|
C12H4Cl4O 305.975000 |
IIKXRERKNIJJQY-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408337; PubChem:CID55112
|
Local ready
Direct docking supported
|
|
E3L055316
BDB055316
|
2,3,4,6-Tetrachlorodibenzofuran
Clc1cc2c(oc3c(Cl)cccc32)c(Cl)c1Cl
|
C12H4Cl4O 305.975000 |
JNVHSHPAAMRSKK-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408338; PubChem:CID44101
|
Local ready
Direct docking supported
|
|
E3L055317
BDB055317
|
1,2,4,6,7-Pentachlorodibenzofuran
Clc1ccc2c(oc3c(Cl)cc(Cl)c(Cl)c32)c1Cl
|
C12H3Cl5O 340.420000 |
BQTCODOVGXJHRB-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408340; PubChem:CID55130
|
Local ready
Direct docking supported
|
|
E3L055318
BDB055318
|
2,3,3',4,4',5-Hexachlorobiphenyl
Clc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)cc1Cl
|
C12H4Cl6 360.882000 |
LCXMEXLGMKFLQO-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408343; PubChem:CID38019
|
Local ready
Direct docking supported
|
|
E3L055319
BDB055319
|
1,2,4,6,8-Pentachlorodibenzofuran
Clc1cc(Cl)c2oc3c(Cl)cc(Cl)c(Cl)c3c2c1
|
C12H3Cl5O 340.420000 |
JDTUAYPJSSXDNO-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408344; PubChem:CID50610
|
Local ready
Direct docking supported
|
|
E3L055320
BDB055320
|
Pcb 47
Clc1ccc(-c2ccc(Cl)cc2Cl)c(Cl)c1
|
C12H6Cl4 291.992000 |
QORAVNMWUNPXAO-UHFFFAOYSA-N | P35869 | Aryl hydrocarbon receptor |
BindingDB, PubChem
BindingDB:BDBM50408345; PubChem:CID17097
|
Local ready
Direct docking supported
|