| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L034421
BDB034421
|
BDBM688258
COc1cccc(CNCCCNc2ccnc3cc(Oc4ccccc4)ccc23)c1O
|
C26H27N3O3 429.520000 |
IFOOAQLHHCZTFQ-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688258; PubChem:CID56593815
|
Local ready
Direct docking supported
|
|
E3L034422
BDB034422
|
BDBM688259
COc1ccccc1Oc1ccc2c(NCCCNCc3cccc(OC)c3O)ccnc2c1
|
C27H29N3O4 459.546000 |
OXOAJWLOPVKOCY-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688259; PubChem:CID56593943
|
Local ready
Direct docking supported
|
|
E3L034423
BDB034423
|
BDBM688260
COc1ccccc1Oc1ccc2c(NCCCNCc3cccc4c3OCO4)ccnc2c1
|
C27H27N3O4 457.530000 |
FOSDHOOBULOCGL-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688260; PubChem:CID56595283
|
Local ready
Direct docking supported
|
|
E3L034424
BDB034424
|
BDBM688261
COc1ccc(F)cc1CNCCCNc1ccnc2cc(Oc3ccccc3OC)ccc12
|
C27H28FN3O3 461.537000 |
QXQZZHIXXFRZNL-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688261; PubChem:CID56593811
|
Local ready
Direct docking supported
|
|
E3L034425
BDB034425
|
BDBM688262
COc1cccc(Oc2ccc3c(NCCCNCc4cccc(OC)c4O)ccnc3c2)c1
|
C27H29N3O4 459.546000 |
YCAZIZPVKFJVPA-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688262; PubChem:CID56593948
|
Local ready
Direct docking supported
|
|
E3L034426
BDB034426
|
BDBM688263
COc1ccc(F)cc1CNCCCNc1ccnc2cc(Oc3ccc(F)cc3)ccc12
|
C26H25F2N3O2 449.501000 |
IGPDNXFHIVFNAJ-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688263; PubChem:CID56595141
|
Local ready
Direct docking supported
|
|
E3L034427
BDB034427
|
BDBM688264
COc1cccc(CNCCCNc2ccnc3cc(Oc4cccc(N(C)C)c4)ccc23)c1O
|
C28H32N4O3 472.589000 |
RDAPASJUMUKOPM-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688264; PubChem:CID56593817
|
Local ready
Direct docking supported
|
|
E3L034428
BDB034428
|
BDBM688265
CN(C)c1cccc(Oc2ccc3c(NCCCNCc4cccc5c4OCO5)ccnc3c2)c1
|
C28H30N4O3 470.573000 |
KXQHTTDFACASBM-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688265; PubChem:CID56593952
|
Local ready
Direct docking supported
|
|
E3L034429
BDB034429
|
BDBM688266
COc1cccc(CNCCCNc2ccnc3cc(CCC(C)C)ccc23)c1O
|
C25H33N3O2 407.558000 |
NSOQZPLDNHNJSZ-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688266; PubChem:CID56595017
|
Local ready
Direct docking supported
|
|
E3L034430
BDB034430
|
BDBM688267
COc1ccc(F)cc1CNCCCNc1ccnc2cc(CCC(C)C)ccc12
|
C25H32FN3O 409.549000 |
HRGLEAFLRXALAK-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688267; PubChem:CID56593805
|
Local ready
Direct docking supported
|
|
E3L034431
BDB034431
|
BDBM688268
CC(C)Cc1ccc2c(NCCCNCc3cccc4c3OCO4)ccnc2c1
|
C24H29N3O2 391.515000 |
HLZCRJZUXIASEM-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688268; PubChem:CID56593650
|
Local ready
Direct docking supported
|
|
E3L034432
BDB034432
|
BDBM688269
COc1ccc(F)cc1CNCCCNc1ccnc2cc(CC(C)C)ccc12
|
C24H30FN3O 395.522000 |
PDSJZBJTEUCZPN-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688269; PubChem:CID56593653
|
Local ready
Direct docking supported
|
|
E3L034433
BDB034433
|
BDBM688270
COc1cccc(CNCCCNc2ccnc3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc23)c1O
|
C28H25F6N3O2 549.515000 |
UAFQAOAAJRIXGD-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688270; PubChem:CID56594619
|
Local ready
Direct docking supported
|
|
E3L034434
BDB034434
|
BDBM688271
COc1ccc(-c2ccc3c(NCCCNCc4cccc(OC)c4O)ccnc3c2)cc1
|
C27H29N3O3 443.547000 |
ZZEKWOJGPASPDB-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688271; PubChem:CID56594355
|
Local ready
Direct docking supported
|
|
E3L034435
BDB034435
|
BDBM688272
COc1ccc(-c2ccc3c(NCCCNCc4cccc5c4OCO5)ccnc3c2)cc1
|
C27H27N3O3 441.531000 |
ZDRPDDVOMVBUDS-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688272; PubChem:CID56594067
|
Local ready
Direct docking supported
|
|
E3L034436
BDB034436
|
BDBM688273
COc1ccc(-c2ccc3c(NCCCNCc4cc(F)ccc4OC)ccnc3c2)cc1
|
C27H28FN3O2 445.538000 |
PZMYISRSNOIZRD-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688273; PubChem:CID56594354
|
Local ready
Direct docking supported
|
|
E3L034437
BDB034437
|
BDBM688274
COc1ccc(F)cc1CNCCCNc1ccnc2cc(Cc3ccc(C#N)cc3)ccc12
|
C28H27FN4O 454.549000 |
DTBHAGQVDWXFMI-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688274; PubChem:CID56593670
|
Local ready
Direct docking supported
|
|
E3L034438
BDB034438
|
BDBM688275
COc1cccc(CNCCCNc2ccnc3cc(Cc4ccccc4)ccc23)c1O
|
C27H29N3O2 427.548000 |
FDGDLJJFDKVIHT-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688275; PubChem:CID56595013
|
Local ready
Direct docking supported
|
|
E3L034439
BDB034439
|
BDBM688276
COc1cccc(F)c1CNCCCNc1ccnc2cc(Cl)ccc12
|
C20H21ClFN3O 373.859000 |
NJQVCNDQOBDNIJ-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688276; PubChem:CID162444620
|
Local ready
Direct docking supported
|
|
E3L034440
BDB034440
|
N-benzyl-N'-(7-chloro-4-quinolyl)propane-1,3-diamine
Clc1ccc2c(NCCCNCc3ccccc3)ccnc2c1
|
C19H20ClN3 325.843000 |
IQPPNWUZVXPERQ-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688277; PubChem:CID11438774
|
Local ready
Direct docking supported
|