| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L061081
BDB061081
|
BDBM50573345
O=C1NCc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC1C23
|
C23H18F4N6O2 486.429000 |
IYGATXOQLMUDRI-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573345
|
Local ready
Direct docking supported
|
|
E3L061082
BDB061082
|
BDBM50573346
Cn1ncc2c1CNC(=O)C1N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C2C13
|
C21H20FN7O2 421.436000 |
XYQAWUHJXRFHIR-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573346
|
Local ready
Direct docking supported
|
|
E3L061083
BDB061083
|
BDBM50573347
O=C1NCc2sccc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC1C23
|
C21H18FN5O2S 423.473000 |
HMRIVVIJEQLJHN-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50573347; PubChem:CID164627290
|
Local ready
Direct docking supported
|
|
E3L061084
BDB061084
|
BDBM50573348
O=C1NCc2ccsc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC1C23
|
C21H18FN5O2S 423.473000 |
KOTRESBCCTWXHF-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB, PubChem
BindingDB:BDBM50573348; PubChem:CID164612058
|
Local ready
Direct docking supported
|
|
E3L061085
BDB061085
|
BDBM50573349
CN1Cc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC(C1=O)C23
|
C24H20F4N6O2 500.456000 |
FCDVIZNUALCVMH-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573349
|
Local ready
Direct docking supported
|
|
E3L061086
BDB061086
|
BDBM50573350
CCN1Cc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC(C1=O)C23
|
C25H22F4N6O2 514.483000 |
YTXJETGIIMBPKL-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573350
|
Local ready
Direct docking supported
|
|
E3L061087
BDB061087
|
BDBM50573351
CC(C)N1Cc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC(C1=O)C23
|
C26H24F4N6O2 528.510000 |
BNVSAXDUUSCZQU-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573351
|
Local ready
Direct docking supported
|
|
E3L061088
BDB061088
|
BDBM50573352
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1C1CC1)C23
|
C26H22F4N6O2 526.494000 |
MQYQKMUBMZFMRY-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573352
|
Local ready
Direct docking supported
|
|
E3L061089
BDB061089
|
BDBM50573353
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1C1CCC1)C23
|
C27H24F4N6O2 540.521000 |
PFMXXKQHVWPAGY-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573353
|
Local ready
Direct docking supported
|
|
E3L061090
BDB061090
|
BDBM50573354
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1CC(F)F)C23
|
C25H20F6N6O2 550.463000 |
VTJYPZHCSHQJME-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573354
|
Local ready
Direct docking supported
|
|
E3L061091
BDB061091
|
BDBM50573355
CC(F)(F)CN1Cc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC(C1=O)C23
|
C26H22F6N6O2 564.490000 |
TVSLZNVEFBHYOJ-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573355
|
Local ready
Direct docking supported
|
|
E3L061092
BDB061092
|
BDBM50573356
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1CC(F)(F)F)C23
|
C25H19F7N6O2 568.453000 |
DSHXJQZGFPNTHF-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573356
|
Local ready
Direct docking supported
|
|
E3L061093
BDB061093
|
BDBM50573357
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1C1CC(F)(F)C1)C23
|
C27H22F6N6O2 576.501000 |
IBCGCBLFZUYFEO-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573357
|
Local ready
Direct docking supported
|
|
E3L061094
BDB061094
|
BDBM50573358
CC(C)(O)CN1Cc2cc(C(F)(F)F)ncc2C2=CN=C(NCc3c(F)ccc4c3CCO4)N3C=NC(C1=O)C23
|
C27H26F4N6O3 558.536000 |
GZINHLZCYGOUOS-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573358
|
Local ready
Direct docking supported
|
|
E3L061095
BDB061095
|
BDBM50573359
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1C1CCOCC1)C23
|
C28H26F4N6O3 570.547000 |
LGNWXTBAJBCGNX-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573359
|
Local ready
Direct docking supported
|
|
E3L061096
BDB061096
|
BDBM50573360
CC1CC(N2Cc3cc(C(F)(F)F)ncc3C3=CN=C(NCc4c(F)ccc5c4CCO5)N4C=NC(C2=O)C34)CC(C)O1
|
C30H30F4N6O3 598.601000 |
HEEKWVPLLAPTSI-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573360
|
Local ready
Direct docking supported
|
|
E3L061097
BDB061097
|
BDBM50573361
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1CC1(O)CC1)C23
|
C27H24F4N6O3 556.520000 |
CLBKJQMFRXONEW-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573361
|
Local ready
Direct docking supported
|
|
E3L061098
BDB061098
|
BDBM50573362
CC1(O)CC(CN2Cc3cc(C(F)(F)F)ncc3C3=CN=C(NCc4c(F)ccc5c4CCO5)N4C=NC(C2=O)C34)C1
|
C29H28F4N6O3 584.574000 |
MUUOPTHUDTVILX-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573362
|
Local ready
Direct docking supported
|
|
E3L061099
BDB061099
|
BDBM50573363
O=C1C2N=CN3C(NCc4c(F)ccc5c4CCO5)=NC=C(c4cnc(C(F)(F)F)cc4CN1CC1CCOCC1)C23
|
C29H28F4N6O3 584.574000 |
RUSPVSQZGAVFJC-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573363
|
Local ready
Direct docking supported
|
|
E3L061100
BDB061100
|
BDBM50573364
CN1CCC(CN2Cc3cc(C(F)(F)F)ncc3C3=CN=C(NCc4c(F)ccc5c4CCO5)N4C=NC(C2=O)C34)CC1
|
C30H31F4N7O2 597.617000 |
HBQPPNWPWADDHS-UHFFFAOYSA-N | O75530 | Polycomb protein EED |
BindingDB
BindingDB:BDBM50573364
|
Local ready
Direct docking supported
|