| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L034321
BDB034321
|
BDBM688150
CCCCCCN(CCC)CCCNc1ccnc2cc(C(F)(F)F)ccc12
|
C22H32F3N3 395.513000 |
MKDFWRPJHSGLNY-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688150; PubChem:CID172057326
|
Local ready
Direct docking supported
|
|
E3L034322
BDB034322
|
BDBM688151
CN(C)c1cccc(Oc2ccc3c(NCCCNCc4ccco4)ccnc3c2)c1
|
C25H28N4O2 416.525000 |
RCKMFSJLMAJGGG-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688151; PubChem:CID56595144
|
Local ready
Direct docking supported
|
|
E3L034323
BDB034323
|
BDBM688152
CC(C)(C)c1ccc(-c2ccc3c(NCCCNCc4ccc5[nH]ccc5c4)ccnc3c2)cc1
|
C31H34N4 462.641000 |
LCHXRONQZUHWNT-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688152; PubChem:CID162444680
|
Local ready
Direct docking supported
|
|
E3L034324
BDB034324
|
BDBM688153
c1ccc2c(NCCCNCc3ccc4[nH]ccc4c3)ccnc2c1
|
C21H22N4 330.435000 |
UMJWTJVGTTUEQK-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688153; PubChem:CID162444676
|
Local ready
Direct docking supported
|
|
E3L034325
BDB034325
|
BDBM688154
FC(F)(F)c1cc(-c2ccc3c(NCCCNCc4ccc5[nH]ccc5c4)ccnc3c2)cc(C(F)(F)F)c1
|
C29H24F6N4 542.527000 |
RHZYVACRVPPZBN-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688154; PubChem:CID162444611
|
Local ready
Direct docking supported
|
|
E3L034326
BDB034326
|
BDBM688155
Clc1ccc2c(NCCCNCc3ccc4[nH]ccc4c3)ccnc2c1
|
C21H21ClN4 364.880000 |
BXKIFBLFURILLT-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688155; PubChem:CID162444657
|
Local ready
Direct docking supported
|
|
E3L034327
BDB034327
|
MAGE-A11 inhibitor SJ521054
FC(F)(F)c1ccc2c(NCCCNCc3ccc4[nH]ccc4c3)ccnc2c1
|
C22H21F3N4 398.432000 |
RBESBYLARHUZNR-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688156; PubChem:CID162444646
|
Local ready
Direct docking supported
|
|
E3L034328
BDB034328
|
BDBM688157
FC(F)(F)c1cc(-c2ccc3c(NCCCNCc4ccco4)ccnc3c2)cc(C(F)(F)F)c1
|
C25H21F6N3O 493.451000 |
INMLCFKPZNAUTD-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688157; PubChem:CID56594623
|
Local ready
Direct docking supported
|
|
E3L034329
BDB034329
|
BDBM688158
Brc1ccc2c(NCCCNCc3ccc4[nH]ccc4c3)ccnc2c1
|
C21H21BrN4 409.331000 |
KHNNKZBLDFRXSH-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688158; PubChem:CID162444685
|
Local ready
Direct docking supported
|
|
E3L034330
BDB034330
|
BDBM688160
Cn1ccc2cc(CNCCCNc3ccnc4cc(C(F)(F)F)ccc34)ccc21
|
C23H23F3N4 412.459000 |
LACOYXYSWQYTKN-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688160; PubChem:CID162444634
|
Local ready
Direct docking supported
|
|
E3L034331
BDB034331
|
BDBM688161
C=CC(=O)N(CCCNc1ccnc2ccccc12)Cc1ccc2[nH]ccc2c1
|
C24H24N4O 384.483000 |
NTVFZLPLSNLLDW-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688161; PubChem:CID162444656
|
Local ready
Direct docking supported
|
|
E3L034332
BDB034332
|
BDBM688162
FC(F)(F)c1ccc(-c2ccc3c(NCCCNCc4cccc5c4OCO5)ccnc3c2)cc1
|
C27H24F3N3O2 479.502000 |
DOONSWGMOUJYBW-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688162; PubChem:CID56594358
|
Local ready
Direct docking supported
|
|
E3L034333
BDB034333
|
BDBM688163
COc1ccc(F)cc1CNCCCNc1ccnc2cc(-c3ccc(C(F)(F)F)cc3)ccc12
|
C27H25F4N3O 483.509000 |
BJIZGJRDAZTXKP-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688163; PubChem:CID56594356
|
Local ready
Direct docking supported
|
|
E3L034334
BDB034334
|
BDBM688164
c1ccc(-c2ccc3c(NCCCNCc4cccc5c4OCO5)ccnc3c2)cc1
|
C26H25N3O2 411.505000 |
OJDAKBIHALTCDI-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688164; PubChem:CID56594216
|
Local ready
Direct docking supported
|
|
E3L034335
BDB034335
|
BDBM688165
FC(F)(F)c1ccc2c(NCCCNCc3ccco3)ccnc2c1
|
C18H18F3N3O 349.356000 |
BIMAXKHEMSOTRD-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688165; PubChem:CID162444679
|
Local ready
Direct docking supported
|
|
E3L034336
BDB034336
|
BDBM688166
FC(F)(F)c1ccc2c(NCCCNCc3ccc4c(c3)OCO4)ccnc2c1
|
C21H20F3N3O2 403.404000 |
HZABUAYATAFOAY-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688166; PubChem:CID162444665
|
Local ready
Direct docking supported
|
|
E3L034337
BDB034337
|
BDBM688168
COc1ccc(F)cc1CNCCCNc1ccnc2cc(-c3ccc(C(C)(C)C)cc3)ccc12
|
C30H34FN3O 471.620000 |
JHEFYLYPOAPJDB-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688168; PubChem:CID56594748
|
Local ready
Direct docking supported
|
|
E3L034338
BDB034338
|
BDBM688169
COc1cccc(CNCCCNc2ccnc3cc(-c4ccc(C(C)(C)C)cc4)ccc23)c1O
|
C30H35N3O2 469.629000 |
XTLNFYXDQBPBLK-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688169; PubChem:CID56594485
|
Local ready
Direct docking supported
|
|
E3L034339
BDB034339
|
BDBM688170
COc1ccc(F)cc1CNCCCNc1ccnc2cc(Oc3cccc(N(C)C)c3)ccc12
|
C28H31FN4O2 474.580000 |
BPOAUWBFJOUOKG-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688170; PubChem:CID56595008
|
Local ready
Direct docking supported
|
|
E3L034340
BDB034340
|
BDBM688171
COc1ccc(F)cc1CNCCCNc1ccnc2cc(Oc3ccc(C(C)(C)C)cc3)ccc12
|
C30H34FN3O2 487.619000 |
OCCDCQZRKAYAOE-UHFFFAOYSA-N | Q9HCI5 | Melanoma-associated antigen E1 |
BindingDB, PubChem
BindingDB:BDBM688171; PubChem:CID56593946
|
Local ready
Direct docking supported
|