Reaction Details Report a problem with these data
Target
DCN1-like protein 1/NEDD8-conjugating enzyme Ubc12
Ligand
BDBM518898
Substrate
n/a
Meas. Tech.
TR-Fret Assay
IC50
<2.90±n/a nM
Citation
 Min, J; Scott, DC; Bhasin, D; Schulman, BA; Singh, B; Hammill, JT; Guy, RK Methods and compositions of inhibiting DCN1-UBC12 interaction US Patent  US11116757 Publication Date 9/14/2021 
Target
Name:
DCN1-like protein 1/NEDD8-conjugating enzyme Ubc12
Synonyms:
DCN1-UBC12
Type:
Protein
Mol. Mass.:
n/a
Description:
n/a
Components:
This complex has 2 components.
Component 1
Name:
NEDD8-conjugating enzyme Ubc12
Synonyms:
2.3.2.- | NEDD8 carrier protein | NEDD8-conjugating enzyme Ubc12 | UBC12 | UBC12_HUMAN | UBE2M | Ubiquitin-conjugating enzyme E2 M
Type:
PROTEIN
Mol. Mass.:
20901.74
Organism:
Homo sapiens
Description:
ChEMBL_118032
Residue:
183
Sequence:
MIKLFSLKQQKKEEESAGGTKGSSKKASAAQLRIQKDINELNLPKTCDISFSDPDDLLNFKLVICPDEGFYKSGKFVFSFKVGQGYPHDPPKVKCETMVYHPNIDLEGNVCLNILREDWKPVLTINSIIYGLQYLFLEPNPEDPLNKEAAEVLQNNRRLFEQNVQRSMRGGYIGSTYFERCLK
  
Component 2
Name:
DCN1-like protein 1
Synonyms:
DCN1 | DCN1-like protein 1 | DCNL1_HUMAN | DCUN1 domain-containing protein 1 | DCUN1D1 | DCUN1L1 | Defective in cullin neddylation protein 1-like protein 1 | RP42 | SCCRO | Squamous cell carcinoma-related oncogene | Synonyms=DCN1
Type:
PROTEIN
Mol. Mass.:
30118.96
Organism:
Homo sapiens
Description:
ChEMBL_117443
Residue:
259
Sequence:
MNKLKSSQKDKVRQFMIFTQSSEKTAVSCLSQNDWKLDVATDNFFQNPELYIRESVKGSLDRKKLEQLYNRYKDPQDENKIGIDGIQQFCDDLALDPASISVLIIAWKFRAATQCEFSKQEFMDGMTELGCDSIEKLKAQIPKMEQELKEPGRFKDFYQFTFNFAKNPGQKGLDLEMAIAYWNLVLNGRFKFLDLWNKFLLEHHKRSIPKDTWNLLLDFSTMIADDMSNYDEEGAWPVLIDDFVEFARPQIAGTKSTTV
  
Inhibitor
Name:
BDBM518898
Synonyms:
US11116757, No. A193
Type:
Small organic molecule
Emp. Form.:
C24H28F3NO
Mol. Mass.:
403.4804
SMILES:
CCCC1CCC(CC1)N(Cc1ccccc1)C(=O)c1cccc(c1)C(F)(F)F |(4.67,-5,;3.33,-4.23,;3.33,-2.69,;2,-1.93,;.67,-2.69,;-.67,-1.93,;-.67,-.38,;.67,.38,;2,-.38,;-2,.38,;-3.33,-.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-2,1.93,;-3.33,2.69,;-.67,2.69,;-.67,4.23,;.67,5,;2,4.23,;2,2.69,;.67,1.93,;3.33,1.93,;4.67,2.69,;3.33,.38,;4.67,1.15,)|
Structure:
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