| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L030741
BDB030741
|
US20230287003, Example 1n
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)NC(C1CCC1)CO2
|
C22H20ClN5O2 421.888000 |
IYECHDVGEPQODK-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618491; PubChem:CID155758517
|
Local ready
Direct docking supported
|
|
E3L030742
BDB030742
|
US20230287003, Example 1o
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)NC1(CCOC1)CCO2
|
C22H20ClN5O3 437.887000 |
HPUBEZRVMQEQPV-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618492; PubChem:CID155758460
|
Local ready
Direct docking supported
|
|
E3L030743
BDB030743
|
US20230287003, Example 1p
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)NC(C(F)F)CCO2
|
C20H16ClF2N5O2 431.830000 |
YQDCNZJTMIVISO-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618493; PubChem:CID146171972
|
Local ready
Direct docking supported
|
|
E3L030744
BDB030744
|
US20230287003, Example 1q
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)NC(C1CC1)C(F)(F)CO2
|
C22H18ClF2N5O2 457.868000 |
NDXNRYJTYFEIAB-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618494; PubChem:CID146171967
|
Local ready
Direct docking supported
|
|
E3L030745
BDB030745
|
US20230287003, Example 1r
C[C@@H]1CN(c2nc(Cl)c(Cl)c(Nc3ccc4c(c3)c3c(c(=O)n4C)OCC[C@H](C4CC4)N3)n2)C[C@H](C)O1
|
C26H30Cl2N6O3 545.471000 |
LYSXIROOOIMFMO-QWQRMKEZSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618495; PubChem:CID146188995
|
Local ready
Direct docking supported
|
|
E3L030746
BDB030746
|
US20230287003, Example 1s
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)N[C@@H](C1CC1)CCS2
|
C22H20ClN5OS 437.956000 |
FHNIONKUBJIVHW-MRXNPFEDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618496; PubChem:CID146188990
|
Local ready
Direct docking supported
|
|
E3L030747
BDB030747
|
US20230287003, Example 1t
CC1CSc2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc3n(C)c2=O)N1
|
C19H16ClN5OS 397.891000 |
ADFUPSFQIKWUEZ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618497; PubChem:CID155758508
|
Local ready
Direct docking supported
|
|
E3L030748
BDB030748
|
US20230287003, Example 1u
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4C#N)ccc31)N[C@@H](C1CC1)CCS2(=O)=O
|
C22H20ClN5O3S 469.954000 |
YJJKIWKERCXMSV-MRXNPFEDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618498; PubChem:CID146189136
|
Local ready
Direct docking supported
|
|
E3L030749
BDB030749
|
US20230287003, Example 2a
C[C@H]1CCOc2c(c3cc(Nc4cc(C(=O)O)nc(Cl)c4C#N)ccc3n(C)c2=O)N1
|
C21H18ClN5O4 439.859000 |
MOACILPHMHIEBM-JTQLQIEISA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618500; PubChem:CID146171977
|
Local ready
Direct docking supported
|
|
E3L030750
BDB030750
|
US20230287003, Example 2b
Cn1c(=O)c2c(c3cc(Nc4nc(C(=O)O)nc(Cl)c4C#N)ccc31)N[C@@H](C1CC1)CCO2
|
C22H19ClN6O4 466.885000 |
MFBJOSKJQIUZBW-CQSZACIVSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618501; PubChem:CID156446617
|
Local ready
Direct docking supported
|
|
E3L030751
BDB030751
|
US20230287003, Example 3a
C[C@H]1CCOc2c(c3cc(Nc4cc(C(=O)N5CCC5)nc(Cl)c4C#N)ccc3n(C)c2=O)N1
|
C24H23ClN6O3 478.940000 |
QTOJOVHQDWPBEI-ZDUSSCGKSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618502; PubChem:CID146171968
|
Local ready
Direct docking supported
|
|
E3L030752
BDB030752
|
US20230287003, Example 3b
Cn1c(=O)c2c(c3cc(Nc4cc(C(=O)N5CC(C(F)(F)F)C5)nc(Cl)c4C#N)ccc31)N[C@@H](C1CC1)CCO2
|
C27H24ClF3N6O3 572.975000 |
NKJJHCGLAJYEPZ-GOSISDBHSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618503; PubChem:CID146188769
|
Local ready
Direct docking supported
|
|
E3L030753
BDB030753
|
US20230287003, Example 4a
C[C@H]1CCOc2c(c3cc(Nc4ccnc(Cl)c4Cl)ccc3n(C)c2=O)N1
|
C19H18Cl2N4O2 405.285000 |
UBJABJQSLUJCGN-JTQLQIEISA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618504; PubChem:CID146172026
|
Local ready
Direct docking supported
|
|
E3L030754
BDB030754
|
US20230287003, Example 4b
COC[C@@H]1CCCN1C(=O)c1cc(Nc2ccc3c(c2)c2c(c(=O)n3C)OCC[C@H](C)N2)c(Cl)cn1
|
C26H30ClN5O4 512.010000 |
DVAMLSVSQRVFON-RDJZCZTQSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618505; PubChem:CID146191445
|
Local ready
Direct docking supported
|
|
E3L030755
BDB030755
|
US20230287003, Example 4c
Cn1c(=O)c2c(c3cc(Nc4ccnc(Cl)c4Cl)ccc31)N[C@@H](C1CC1)CCO2
|
C21H20Cl2N4O2 431.323000 |
VGGMRKDZUASPTK-CQSZACIVSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618506; PubChem:CID146191441
|
Local ready
Direct docking supported
|
|
E3L030756
BDB030756
|
US20230287003, Example 4d
Cn1c(=O)c2c(c3cc(Nc4ccncc4Cl)ccc31)N[C@@H](C1CC1)C(F)(F)CO2
|
C21H19ClF2N4O2 432.858000 |
FPMMRNJSPJNIBE-IBGZPJMESA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618507; PubChem:CID146191444
|
Local ready
Direct docking supported
|
|
E3L030757
BDB030757
|
US20230287003, Example 5a
Cn1c(=O)c2c(c3cc(Nc4nc(-n5ccc(C(F)(F)F)n5)ncc4Cl)ccc31)N[C@@H](C1CC1)CCO2
|
C24H21ClF3N7O2 531.926000 |
LJOMKTQOWUJNTH-MRXNPFEDSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618508; PubChem:CID146188992
|
Local ready
Direct docking supported
|
|
E3L030758
BDB030758
|
US20230287003, Example 5b
COCC1(C)CCOc2c(c3cc(Nc4nc(-n5ccc(C(F)(F)F)n5)ncc4Cl)ccc3n(C)c2=O)N1
|
C24H23ClF3N7O3 549.941000 |
LFUMMXUIWDXRKJ-UHFFFAOYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618509; PubChem:CID155758468
|
Local ready
Direct docking supported
|
|
E3L030759
BDB030759
|
US20230287003, Example 5c
C[C@H]1CCOc2c(c3cc(Nc4nc(-n5ccc(C(F)(F)F)n5)ncc4Cl)ccc3n(C)c2=O)N1
|
C22H19ClF3N7O2 505.888000 |
CAGMUBUQVMFVNL-NSHDSACASA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618510; PubChem:CID146188918
|
Local ready
Direct docking supported
|
|
E3L030760
BDB030760
|
US20230287003, Example 5d
C[C@H]1CCOc2c(c3cc(Nc4nc(N5CCC(C(=O)N(C)C)CC5)ncc4Cl)ccc3n(C)c2=O)N1
|
C26H32ClN7O3 526.041000 |
QCUPYMGPYYDREU-HNNXBMFYSA-N | P41182 | B-cell lymphoma 6 protein |
BindingDB, PubChem
BindingDB:BDBM618511; PubChem:CID146188919
|
Local ready
Direct docking supported
|