| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L012721
BDB012721
|
US10040779, Example 70
N#CNC(=O)c1ccncc1Nc1nn([C@H]2CCOC2)c2ccc(F)cc12
|
C18H15FN6O2 366.356000 |
CIVLISPQADTQPF-LBPRGKRZSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277773; PubChem:CID90216605
|
Local ready
Direct docking supported
|
|
E3L012722
BDB012722
|
US10040779, Example 71
O=C(O)c1ccncc1Nc1nn(CCN2CCC(F)(F)C2)c2ccc(F)cc12
|
C19H18F3N5O2 405.380000 |
ZMOBJOVSRLSQAJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277774; PubChem:CID90216452
|
Local ready
Direct docking supported
|
|
E3L012723
BDB012723
|
US10040779, Example 72
N#CNC(=O)c1ccncc1Nc1nn(CCN2CCC(F)(F)C2)c2ccc(F)cc12
|
C20H18F3N7O 429.406000 |
MBPMGMRWKUDDJJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277775; PubChem:CID90216394
|
Local ready
Direct docking supported
|
|
E3L012724
BDB012724
|
US10040779, Example 74
N#CNC(=O)c1ccncc1Nc1nn(CCN2CCC(F)(F)CC2)c2ccc(F)cc12
|
C21H20F3N7O 443.433000 |
CRBLXBRTKXHMBY-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277777; PubChem:CID90216543
|
Local ready
Direct docking supported
|
|
E3L012725
BDB012725
|
US10040779, Example 76
CN(C)CCCCn1nc(Nc2cnccc2C(=O)NC#N)c2cc(F)ccc21
|
C20H22FN7O 395.442000 |
OICXADQLCUCUMI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277779; PubChem:CID90216598
|
Local ready
Direct docking supported
|
|
E3L012726
BDB012726
|
US10040779, Example 77
N#CNC(=O)c1ccncc1Nc1nn(CCN2CCCC2)c2ccc(F)cc12
|
C20H20FN7O 393.426000 |
AXCZGZNCDYAGSY-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277780; PubChem:CID90216618
|
Local ready
Direct docking supported
|
|
E3L012727
BDB012727
|
US10040779, Example 78
O=C(O)c1ccncc1Nc1nn(CCN2CCCC2)c2ccc(Cl)cc12
|
C19H20ClN5O2 385.855000 |
KHVBTGDZMFHBJJ-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277781; PubChem:CID90216498
|
Local ready
Direct docking supported
|
|
E3L012728
BDB012728
|
US10040779, Example 79
N#CNC(=O)c1ccncc1Nc1nn(CCN2CCCC2)c2ccc(Cl)cc12
|
C20H20ClN7O 409.881000 |
COKQEBSDGZNRLI-UHFFFAOYSA-N | P29375 | Lysine-specific demethylase 5A |
BindingDB, PubChem
BindingDB:BDBM277782; PubChem:CID90216560
|
Local ready
Direct docking supported
|
|
E3L012729
BDB012729
|
BDBM279791
CC(Cn1cnc2c(=O)[nH]c(N)nc21)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O
|
C9H16N5O11P3 463.173000 |
BCWHUAAXZLXYJG-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279791; PubChem:CID136238590
|
Local ready
Direct docking supported
|
|
E3L012730
BDB012730
|
BDBM279792
CC(Cn1cnc2c(=S)[nH]c(N)nc21)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O
|
C9H16N5O10P3S 479.241000 |
CJFWAOPRJDTSNT-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279792; PubChem:CID89664426
|
Local ready
Direct docking supported
|
|
E3L012731
BDB012731
|
BDBM279793
Nc1nc2c(ncn2CCCOCP(=O)(O)OP(=O)(O)OP(=O)(O)O)c(=O)[nH]1
|
C9H16N5O11P3 463.173000 |
GKHRRNIGKXAIJC-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279793; PubChem:CID136238589
|
Local ready
Direct docking supported
|
|
E3L012732
BDB012732
|
BDBM279794
CC[C@H](Cn1cnc2c(=O)[nH]c(N)nc21)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O
|
C10H18N5O11P3 477.200000 |
VNXNKPHRRCSEBJ-ZCFIWIBFSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279794; PubChem:CID136635836
|
Local ready
Direct docking supported
|
|
E3L012733
BDB012733
|
BDBM279795
C[C@H](CCn1cnc2c(=O)[nH]c(N)nc21)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O
|
C10H18N5O11P3 477.200000 |
FSDXJJSOXDTYGR-ZCFIWIBFSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279795; PubChem:CID136635837
|
Local ready
Direct docking supported
|
|
E3L012734
BDB012734
|
BDBM279796
Nc1nc2c(ncn2CC(CF)OCP(=O)(O)OP(=O)(O)OP(=O)(O)O)c(=O)[nH]1
|
C9H15FN5O11P3 481.163000 |
JDXVEGFCLKAMIH-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279796; PubChem:CID136238592
|
Local ready
Direct docking supported
|
|
E3L012735
BDB012735
|
BDBM279797
C=C(COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21
|
C10H16N5O11P3 475.184000 |
QZFNVLVIMCGLEH-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279797; PubChem:CID136238599
|
Local ready
Direct docking supported
|
|
E3L012736
BDB012736
|
BDBM279798
CC(COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)Cn1cnc2c(=O)[nH]c(N)nc21
|
C10H18N5O11P3 477.200000 |
KUZHPABRZCTOEG-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279798; PubChem:CID136238595
|
Local ready
Direct docking supported
|
|
E3L012737
BDB012737
|
BDBM279799
CC(COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)n1cnc2c(=O)[nH]c(N)nc21
|
C9H16N5O11P3 463.173000 |
NKFNHZXNCGRVDQ-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279799; PubChem:CID136238596
|
Local ready
Direct docking supported
|
|
E3L012738
BDB012738
|
BDBM279800
CC(Cn1cnc2c(=O)[nH]c(N)nc21)OCP(=O)(O)O
|
C9H14N5O5P 303.215000 |
LDQMGQXMJIFSNJ-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279800; PubChem:CID135410348
|
Local ready
Direct docking supported
|
|
E3L012739
BDB012739
|
BDBM279801
CC(C)OC(=O)OCOP(=O)(COC(C)Cn1cnc2c(=O)[nH]c(N)nc21)OCOC(=O)OC(C)C
|
C19H30N5O11P 535.447000 |
XMEFOQQJHRHEMQ-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279801; PubChem:CID136635844
|
Local ready
Direct docking supported
|
|
E3L012740
BDB012740
|
BDBM279802
CC(Cn1cnc2c(=S)[nH]c(N)nc21)OCP(=O)(O)O
|
C9H14N5O4PS 319.283000 |
IAFONVIGGMKJMK-UHFFFAOYSA-N | Q99973 | Telomerase protein component 1 |
BindingDB, PubChem
BindingDB:BDBM279802; PubChem:CID18765100
|
Local ready
Direct docking supported
|