| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L066906
LIG001476
|
21a
Cc1ccc(NC(=O)NCc2cccc3nnn(C4CCC(=O)NC4=O)c(=O)c23)cc1Cl
|
C21H19ClN6O4 454.874000 |
TZOPVMYYPPJPRJ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB355
|
Local ready
Direct docking supported
|
|
E3L066907
LIG001477
|
QXG-6113
O=C1CCC(N2Cc3ccc(NC(=O)c4cn5ccccc5n4)cc3C2=O)C(=O)N1
|
C21H17N5O4 403.398000 |
UACDTPLSFIBBRI-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1054
|
Local ready
Direct docking supported
|
|
E3L066909
LIG001479
|
Lib-D-18J
CN1C(=O)CCC(N2Cc3c(cccc3-c3ccccc3OCC(=O)N/N=C/c3nn(Cc4ccccc4)c4ccccc34)C2=O)C1=O
|
C37H32N6O5 640.700000 |
UAMMSXWAEMFNRY-CHSHITCJSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB537
|
Local ready
Direct docking supported
|
|
E3L066910
LIG001480
|
14
CC(C)(c1ccc(OCC2CCN(C3CN(C(=O)CNc4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)C3)CC2)cc1)c1ccc(OC[C@H](O)CCl)cc1
|
C42H48ClN5O8 786.326000 |
UAPZPARJSOVMHI-RACIXVTASA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1545
|
Local ready
Direct docking supported
|
|
E3L066911
LIG001481
|
L01
O=C1CCC(N2Cc3c(NCCOCCOCCOCc4ccccc4)cccc3C2=O)C(=O)N1
|
C26H31N3O6 481.549000 |
UBCFPPCZFTXTMK-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1098
|
Local ready
Direct docking supported
|
|
E3L066912
LIG001482
|
4g
COC(=O)c1nc(NC(=O)Cn2cnc(C)c(C)c2=O)sc1CCc1ccc(Cl)cc1
|
C21H21ClN4O4S 460.943000 |
UBFKCJTTZKCOKG-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1477
|
Local ready
Direct docking supported
|
|
E3L066913
LIG001483
|
17
CC(C)(c1ccc(OCC2CCN(C3CN(C(=O)CCCCNc4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)C3)CC2)cc1)c1ccc(OC[C@H](O)CCl)cc1
|
C45H54ClN5O8 828.407000 |
UBMALUFLQUDBDR-PQVOGGOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1548
|
Local ready
Direct docking supported
|
|
E3L066914
LIG001484
|
22k
O=C1CCC(n2nnc3ccc(CNC(=O)Nc4cc(Cl)cc(Cl)c4)cc3c2=O)C(=O)N1
|
C20H16Cl2N6O4 475.292000 |
UBPLHIIGCHEJHL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB990
|
Local ready
Direct docking supported
|
|
E3L066915
LIG001485
|
13
CN(CCCOc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O)CC1CCC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(C(C)(C)O)cc3n2)CC1
|
C41H46F3N7O6 789.856000 |
UBZCBNADOGDNJL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB525
|
Local ready
Direct docking supported
|
|
E3L066916
LIG001486
|
(S,S)-3b
C[C@@]1(C(=O)NC2CCCCC2)CCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C17H25N3O4 335.404000 |
UCJGHPMMJYALRJ-SJCJKPOMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB8
|
Local ready
Direct docking supported
|
|
E3L066917
LIG001487
|
(R,S)-3b
C[C@]1(C(=O)NC2CCCCC2)CCC(=O)N1[C@H]1CCC(=O)NC1=O
|
C17H25N3O4 335.404000 |
UCJGHPMMJYALRJ-YVEFUNNKSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB15
|
Local ready
Direct docking supported
|
|
E3L066918
LIG001488
|
cmp17
O=C1CCC(N2Cc3c(OCc4ccc(CN5CCN(c6c(F)cccc6F)CC5)cc4)cccc3C2=O)C(=O)N1
|
C31H30F2N4O4 560.601000 |
UCKHUZVOPCGPHV-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1109
|
Local ready
Direct docking supported
|
|
E3L066919
LIG001489
|
ZZ7-16-066
CC(C)S(=O)(=O)c1ccccc1Nc1nc(N[C@@H]2CCCN(C(=O)c3cccnc3)C2)ncc1Cl
|
C24H27ClN6O3S 515.039000 |
UCKLOAUXSQRYPM-GOSISDBHSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB173
|
Local ready
Direct docking supported
|
|
E3L066920
LIG001490
|
L4
COC(=O)c1ccc(NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)n(Cc3ccccc3)c2=O)cc1
|
C27H24N4O5 484.512000 |
UCNVKIDMPFWQNQ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB605
|
Local ready
Direct docking supported
|
|
E3L066921
LIG001491
|
17
O=C1CCC(N2Cc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C2=O)C(=O)N1
|
C21H16F3N3O4 431.370000 |
UCPCJPWMCSITTJ-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1059
|
Local ready
Direct docking supported
|
|
E3L066922
LIG001492
|
GBD-16
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2[C@@H]1CCCN(C(=O)CCOCCOCCNc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)C1
|
C42H43N9O8 801.861000 |
UCTGQBPFCSBHTA-TUDONDPESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB833
|
Local ready
Direct docking supported
|
|
E3L066923
LIG001493
|
L7
CCOC(=O)C1CCCCN1C(=O)c1nn(-c2ccc(C)c(C)c2)c(=O)n(Cc2ccccc2)c1=O
|
C27H30N4O5 490.560000 |
UCWQZDGRBVCQRL-UHFFFAOYSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB488
|
Local ready
Direct docking supported
|
|
E3L066924
LIG001494
|
LYG-105
O=C1CCC(N2Cc3cc(CNC(=O)/C(Cc4ccc(N5CCOCC5)cc4)=N/O)ccc3C2=O)C(=O)N1
|
C27H29N5O6 519.558000 |
UDHCZJYNBCVWFR-JBASAIQMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB1324
|
Local ready
Direct docking supported
|
|
E3L066925
LIG001495
|
ZZ3-Ent
CC(C)S(=O)(=O)c1ccccc1Nc1nc(N[C@H]2CCCN(C(=O)c3ccccc3)C2)ncc1Cl
|
C25H28ClN5O3S 514.051000 |
UDXXTSWRYRQIPG-IBGZPJMESA-N | - | - |
MolGlueDB
MolGlueDB:MGDB177
|
Local ready
Direct docking supported
|
|
E3L066926
LIG001496
|
ZZ3
CC(C)S(=O)(=O)c1ccccc1Nc1nc(N[C@@H]2CCCN(C(=O)c3ccccc3)C2)ncc1Cl
|
C25H28ClN5O3S 514.051000 |
UDXXTSWRYRQIPG-LJQANCHMSA-N | - | - |
MolGlueDB
MolGlueDB:MGDB165
|
Local ready
Direct docking supported
|