| Compound ID | Name | Formula / MW | InChIKey | E3 | Target | Source | Docking structure |
|---|---|---|---|---|---|---|---|
|
E3L022081
BDB022081
|
4-Benzothiazol-2-ylpiperidyl 4-fluorophenyl ketone
O=C(c1ccc(F)cc1)N1CCC(c2nc3ccccc3s2)CC1
|
C19H17FN2OS 340.423000 |
AQTOKFFKMAXFDC-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519223; PubChem:CID16015842
|
Local ready
Direct docking supported
|
|
E3L022082
BDB022082
|
US11116757, No. D16
O=C(c1ccc(F)cc1)N1CCCC(c2nc3ccccc3s2)C1
|
C19H17FN2OS 340.423000 |
ORDNCZIQCKSMDD-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519224; PubChem:CID16857585
|
Local ready
Direct docking supported
|
|
E3L022083
BDB022083
|
US11116757, No. D17
Cc1ccc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1C
|
C21H22N2OS 350.487000 |
XIIDIDSTTISEHV-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519225; PubChem:CID9218762
|
Local ready
Direct docking supported
|
|
E3L022084
BDB022084
|
US11116757, No. D18
O=C(c1cccc(Br)c1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1
|
C19H16BrClN2OS 435.774000 |
NXBJIKUYGULSCQ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519226; PubChem:CID16310526
|
Local ready
Direct docking supported
|
|
E3L022085
BDB022085
|
BDBM519227
COc1ccc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1OC
|
C21H22N2O3S 382.485000 |
VWLYIOIZKYQUHK-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519227; PubChem:CID1430083
|
Local ready
Direct docking supported
|
|
E3L022086
BDB022086
|
2-[1-(4-Chlorobenzoyl)piperidin-4-yl]-1,3-benzothiazole
O=C(c1ccc(Cl)cc1)N1CCC(c2nc3ccccc3s2)CC1
|
C19H17ClN2OS 356.878000 |
NZINWFDLRBNCBJ-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519228; PubChem:CID1453023
|
Local ready
Direct docking supported
|
|
E3L022087
BDB022087
|
US11116757, No. D21
COc1cc(SC)ccc1C(=O)N1CCC(c2nc3ccccc3s2)CC1
|
C21H22N2O2S2 398.553000 |
UPUFSEOISAIKBO-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519229; PubChem:CID9515620
|
Local ready
Direct docking supported
|
|
E3L022088
BDB022088
|
BDBM519230
COc1cc(OC)cc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)c1
|
C21H22N2O3S 382.485000 |
ZAHVVXPPIJJBOB-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519230; PubChem:CID1430071
|
Local ready
Direct docking supported
|
|
E3L022089
BDB022089
|
US11116757, No. D23
O=C(NCC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1cccc(F)c1
|
C21H20FN3O2S 397.475000 |
OFFQIVKIKASOJV-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519231; PubChem:CID9218685
|
Local ready
Direct docking supported
|
|
E3L022090
BDB022090
|
US11116757, No. D24
COc1cc(C(=O)N2CCCC(c3nc4ccccc4s3)C2)cc(OC)c1OCC(N)=O
|
C23H25N3O5S 455.536000 |
RZHPQXHXTQGEQN-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519232; PubChem:CID22109000
|
Local ready
Direct docking supported
|
|
E3L022091
BDB022091
|
US11116757, No. D25
CCOc1ccc(C(=O)N2CCCC(c3nc4ccccc4s3)C2)cc1
|
C21H22N2O2S 366.486000 |
BIGNXFRSBOJZTH-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519233; PubChem:CID16857646
|
Local ready
Direct docking supported
|
|
E3L022092
BDB022092
|
US11116757, No. D26
COc1ccc(C(=O)NCC(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1OC
|
C23H25N3O4S 439.537000 |
NMRIMEIDOOJFHK-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519234; PubChem:CID17492575
|
Local ready
Direct docking supported
|
|
E3L022093
BDB022093
|
US11116757, No. D27
O=C(c1ccc(Br)cc1)N1CCCC(c2nc3ccccc3s2)C1
|
C19H17BrN2OS 401.329000 |
AUEGBCASXVAIGP-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519235; PubChem:CID16857587
|
Local ready
Direct docking supported
|
|
E3L022094
BDB022094
|
US11116757, No. D28
CCOc1cc(C(=O)N2CCCC(c3nc4ccccc4s3)C2)cc(Br)c1OC
|
C22H23BrN2O3S 475.408000 |
OJVDPWNGJNMAFF-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519236; PubChem:CID17494348
|
Local ready
Direct docking supported
|
|
E3L022095
BDB022095
|
US11116757, No. D29
O=C(c1ccccc1O)N1CCC(c2nc3ccccc3s2)CC1
|
C19H18N2O2S 338.432000 |
PZTCFZKSZYQDSI-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519237; PubChem:CID17494636
|
Local ready
Direct docking supported
|
|
E3L022096
BDB022096
|
US11116757, No. D30
COc1cc(OC)cc(C(=O)N2CCCC(c3nc4ccccc4s3)C2)c1
|
C21H22N2O3S 382.485000 |
LAFWSDIPPPKQMM-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519238; PubChem:CID16857592
|
Local ready
Direct docking supported
|
|
E3L022097
BDB022097
|
US11116757, No. D31
O=C(c1ccc(I)cc1)N1CCCC(c2nc3ccccc3s2)C1
|
C19H17IN2OS 448.329000 |
ARVVYWHFZNIDAM-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519239; PubChem:CID17493949
|
Local ready
Direct docking supported
|
|
E3L022098
BDB022098
|
US11116757, No. D32
Cc1cc(C)cc(C(=O)N2CCCC(c3nc4ccccc4s3)C2)c1
|
C21H22N2OS 350.487000 |
QFVNNWSNXUCYAA-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519240; PubChem:CID17493952
|
Local ready
Direct docking supported
|
|
E3L022099
BDB022099
|
US11116757, No. D33
CCOc1ccc(C(=O)NCC(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1
|
C23H25N3O3S 423.538000 |
BAWDHJMOPUMRSD-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519241; PubChem:CID9218690
|
Local ready
Direct docking supported
|
|
E3L022100
BDB022100
|
US11116757, No. E1
CCCN1CCN(C(=O)c2cnn(-c3nccc(-c4cccs4)n3)c2C(C)C)CC1
|
C22H28N6OS 424.574000 |
FUHAKCFFVGNYJF-UHFFFAOYSA-N | Q96GG9 | DCN1-like protein 1 |
BindingDB, PubChem
BindingDB:BDBM519242; PubChem:CID26326454
|
Local ready
Direct docking supported
|