Reaction Details
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Target
Adenosine kinase
Ligand
BDBM50339503
Substrate
n/a
Meas. Tech.
ChEMBL_736608 (CHEMBL1694989)
IC50
200000±n/a nM
Citation
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More Info.:
Target
Name:
Adenosine kinase
Synonyms:
ADK | ADK_HUMAN
Type:
PROTEIN
Mol. Mass.:
40545.97
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1467841
Residue:
362
Sequence:
MAAAEEEPKPKKLKVEAPQALRENILFGMGNPLLDISAVVDKDFLDKYSLKPNDQILAEDKHKELFDELVKKFKVEYHAGGSTQNSIKVAQWMIQQPHKAATFFGCIGIDKFGEILKRKAAEAHVDAHYYEQNEQPTGTCAACITGDNRSLIANLAAANCYKKEKHLDLEKNWMLVEKARVCYIAGFFLTVSPESVLKVAHHASENNRIFTLNLSAPFISQFYKESLMKVMPYVDILFGNETEAATFAREQGFETKDIKEIAKKTQALPKMNSKRQRIVIFTQGRDDTIMATESEVTAFAVLDQDQKEIIDTNGAGDAFVGGFLSQLVSDKPLTECIRAGHYAASIIIRRTGCTFPEKPDFH
Inhibitor
Name:
BDBM50339503
Synonyms:
(+/-)-6-Ethyl-6-[4-[3-(2-diethylamino)ethylphenoxymethyl]-phenyl]-6,7-dihydrobenzo[b]pyrrolo[1,2-d][1,4]oxazepin-7-one | CHEMBL1688586
Type:
Small organic molecule
Emp. Form.:
C33H36N2O3
Mol. Mass.:
508.6505
SMILES:
CCN(CC)CCc1cccc(OCc2ccc(cc2)C2(CC)Oc3ccccc3-n3cccc3C2=O)c1