Reaction Details
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Target
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
Ligand
BDBM50017337
Substrate
n/a
Meas. Tech.
ChEMBL_1362418 (CHEMBL3292526)
IC50
0.079433±n/a nM
Citation
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More Info.:
Target
Name:
cAMP-specific 3',5'-cyclic phosphodiesterase 4B
Synonyms:
3',5'-cyclic phosphodiesterase | DPDE4 | Isoform PDE4B1 | PDE32 | PDE4B | PDE4B1 | PDE4B_HUMAN | Phosphodiesterase 4B | Phosphodiesterase 4B (PDE4B) | Phosphodiesterase 4B (PDE4B1) | Phosphodiesterase Type 4 (PDE4B)
Type:
Protein
Mol. Mass.:
83318.87
Organism:
Homo sapiens (Human)
Description:
Q07343
Residue:
736
Sequence:
MKKSRSVMTVMADDNVKDYFECSLSKSYSSSSNTLGIDLWRGRRCCSGNLQLPPLSQRQSERARTPEGDGISRPTTLPLTTLPSIAITTVSQECFDVENGPSPGRSPLDPQASSSAGLVLHATFPGHSQRRESFLYRSDSDYDLSPKAMSRNSSLPSEQHGDDLIVTPFAQVLASLRSVRNNFTILTNLHGTSNKRSPAASQPPVSRVNPQEESYQKLAMETLEELDWCLDQLETIQTYRSVSEMASNKFKRMLNRELTHLSEMSRSGNQVSEYISNTFLDKQNDVEIPSPTQKDREKKKKQQLMTQISGVKKLMHSSSLNNTSISRFGVNTENEDHLAKELEDLNKWGLNIFNVAGYSHNRPLTCIMYAIFQERDLLKTFRISSDTFITYMMTLEDHYHSDVAYHNSLHAADVAQSTHVLLSTPALDAVFTDLEILAAIFAAAIHDVDHPGVSNQFLINTNSELALMYNDESVLENHHLAVGFKLLQEEHCDIFMNLTKKQRQTLRKMVIDMVLATDMSKHMSLLADLKTMVETKKVTSSGVLLLDNYTDRIQVLRNMVHCADLSNPTKSLELYRQWTDRIMEEFFQQGDKERERGMEISPMCDKHTASVEKSQVGFIDYIVHPLWETWADLVQPDAQDILDTLEDNRNWYQSMIPQSPSPPLDEQNRDCQGLMEKFQFELTLDEEDSEGPEKEGEGHSYFSSTKTLCVIDPENRDSLGETDIDIATEDKSPVDT
Inhibitor
Name:
BDBM50017337
Synonyms:
CHEMBL3288026
Type:
Small organic molecule
Emp. Form.:
C37H44FN7O4
Mol. Mass.:
669.7882
SMILES:
C[C@H]1CN(Cc2cccc(c2O)-c2cccc(Oc3ncc(F)cc3C(=O)N[C@@H]3CC[C@@H](CC3)NC(=O)c3cc(C)n(C)n3)c2)C[C@@H](C)N1 |r,wU:46.51,1.0,31.36,28.29,(20.28,-61.8,;20.29,-60.27,;18.98,-59.49,;18.99,-57.96,;17.63,-57.24,;16.31,-58.02,;16.32,-59.57,;14.99,-60.35,;13.65,-59.59,;13.65,-58.04,;14.97,-57.26,;14.96,-55.73,;12.31,-57.28,;10.97,-58.06,;9.64,-57.29,;9.64,-55.75,;10.97,-54.98,;10.97,-53.44,;9.63,-52.67,;8.29,-53.44,;6.95,-52.67,;6.95,-51.12,;5.62,-50.35,;8.29,-50.35,;9.63,-51.11,;10.96,-50.34,;10.95,-48.8,;12.3,-51.1,;13.63,-50.33,;14.97,-51.1,;16.3,-50.34,;16.3,-48.79,;14.96,-48.02,;13.62,-48.8,;17.64,-48.02,;18.98,-48.79,;18.98,-50.34,;20.2,-47.84,;20.15,-46.32,;21.6,-45.8,;22.03,-44.32,;22.54,-47.02,;24.08,-46.97,;21.68,-48.29,;12.3,-55.74,;20.31,-57.19,;21.64,-57.97,;22.98,-57.21,;21.63,-59.51,)|