| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L037861
BDB037861
|
BDBM742393
CCN1C(=O)[C@@H](NC(=O)c2cccc(F)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H33FN6O4 560.630000 |
VPUVTROHNNVKHG-JBKQJTDBSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742393
|
Local ready
Direct docking supported
|
|
E3L037862
BDB037862
|
BDBM742394
CCN1C(=O)[C@@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H42N8O4 602.740000 |
VUZOHKCRYNODPI-ZCQCUXIGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742394
|
Local ready
Direct docking supported
|
|
E3L037863
BDB037863
|
BDBM742395
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CCC2)c2c(C(=O)N3CCC[C@H]3C#N)nn(C3CCOCC3)c21
|
C31H35F3N6O4 612.653000 |
LKTNWUHWYLJZQC-LSQMVHIFSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742395; PubChem:CID176734113
|
Local ready
Direct docking supported
|
|
E3L037864
BDB037864
|
BDBM742396
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CC[C@H](NC)[C@H]3C#N)nn(C3CCOCC3)c21
|
C34H35F4N7O4 681.691000 |
AZUUHGQOTMNJMF-RVUATISTSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742396
|
Local ready
Direct docking supported
|
|
E3L037865
BDB037865
|
BDBM742397
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](c2ccc(F)cc2)c2c(C(=O)N3CC[C@H](F)[C@H]3C#N)nn(C3CCOCC3)c21
|
C33H31F5N6O4 670.639000 |
AWSBITYZLPLPFE-SFIUMABJSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742397
|
Local ready
Direct docking supported
|
|
E3L037866
BDB037866
|
BDBM742398
CCN1C(=O)[C@@H](NC(=O)c2ccc3c(c2)OCCO3)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H36N6O6 600.676000 |
BBCYYHAQGCGDIY-GASWHMOUSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742398
|
Local ready
Direct docking supported
|
|
E3L037867
BDB037867
|
BDBM742399
CCC(=O)N[C@@H]1C(=O)N(CC)c2c(c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn2C2CCOCC2)[C@@H]1C1CC1
|
C26H34N6O4 494.596000 |
WGTSWDGUMAYIJL-DWHDJPSKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742399
|
Local ready
Direct docking supported
|
|
E3L037868
BDB037868
|
BDBM742400
CCN1C(=O)[C@@H](NC(=O)c2c(Cl)ccc(OC)c2F)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H34ClFN6O5 625.101000 |
TYDXPPWLXQCKTI-UUGAXHFOSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742400
|
Local ready
Direct docking supported
|
|
E3L037869
BDB037869
|
BDBM742401
CCN1C(=O)[C@@H](NC(=O)c2cccc(C#N)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H33N7O4 567.650000 |
KYXPWLRYKXDBGA-UDODTCMPSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742401
|
Local ready
Direct docking supported
|
|
E3L037870
BDB037870
|
BDBM742402
CCN1C(=O)[C@@H](NC(=O)C(C2CC2)C2CC2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C31H40N6O4 560.699000 |
OGVQAQGPWSGPLM-PVIHEHHISA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742402
|
Local ready
Direct docking supported
|
|
E3L037871
BDB037871
|
BDBM742403
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)CC[C@@H]3C)nn(C3CCOCC3)c21
|
C31H35F3N6O4 612.653000 |
KNGNCULZPNZSGY-CFZKCAPKSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742403
|
Local ready
Direct docking supported
|
|
E3L037872
BDB037872
|
BDBM742404
CCN1C(=O)[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H35F3N6O4 600.642000 |
WHKHYVJCIVCXSO-MJVDFARWSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742404
|
Local ready
Direct docking supported
|
|
E3L037873
BDB037873
|
BDBM742405
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N(CC#N)C3CC3)nn(C3CC3)c21
|
C28H29F3N6O3 554.573000 |
OKFDCMJHNYPRHO-UNMCSNQZSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM742405; PubChem:CID176734121
|
Local ready
Direct docking supported
|
|
E3L037874
BDB037874
|
BDBM742406
CCN1C(=O)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C2CC2)c2c(C(=O)N3[C@@H](C#N)C[C@@H]4C[C@@H]43)nn(C3CCOCC3)c21
|
C31H33F3N6O4 610.637000 |
NLKOCBKHTSEYIW-KPVGUCBVSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742406
|
Local ready
Direct docking supported
|
|
E3L037875
BDB037875
|
BDBM742407
CCN1C(=O)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn([C@@H]3CCOC3)c21
|
C33H30F4N6O4 650.633000 |
OREQYUODEAONAK-UVNKEFLNSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742407
|
Local ready
Direct docking supported
|
|
E3L037876
BDB037876
|
BDBM742408
CCN1C(=O)[C@@H](NC(=O)c2ccc3nn[nH]c3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H33N9O4 583.653000 |
WIMXXYMQVTVYQP-TZGDUONMSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742408
|
Local ready
Direct docking supported
|
|
E3L037877
BDB037877
|
BDBM742409
CCN1C(=O)[C@@H](NC(=O)c2ccc3snnc3c2)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C30H32N8O4S 600.705000 |
RTXKFPSBSGYFBS-HELRIWKGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742409
|
Local ready
Direct docking supported
|
|
E3L037878
BDB037878
|
BDBM742410
CCN1C(=O)[C@@H](NC(=O)c2cccc3ccoc23)[C@@H](C2CC2)c2c(C(=O)N3[C@H](C#N)C[C@H]4C[C@H]43)nn(C3CCOCC3)c21
|
C32H34N6O5 582.661000 |
UWXXQUGFCYNMQK-ZCQCUXIGSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB
BindingDB:BDBM742410
|
Local ready
Direct docking supported
|
|
E3L037879
BDB037879
|
BDBM743399
COc1cc(F)c(-c2cc(Cc3cnc4c(N)nccn34)c(N3CCC[C@](N)([C@H](O)C(F)F)C3)cn2)cc1F
|
C26H27F4N7O2 545.541000 |
DKWCIRQLXJVTBM-ATIYNZHBSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM743399; PubChem:CID176360497
|
Local ready
Direct docking supported
|
|
E3L037880
BDB037880
|
BDBM743400
COc1cc(F)c(-c2cc(Cn3cnc4cncnc43)c(N3CCC[C@](N)([C@H](O)C(F)F)C3)cn2)cc1F
|
C25H25F4N7O2 531.514000 |
OLRYBWJMAKXKTF-RCZVLFRGSA-N | O96028 | Histone-lysine N-methyltransferase NSD2 |
BindingDB, PubChem
BindingDB:BDBM743400; PubChem:CID176734151
|
Local ready
Direct docking supported
|