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BDBM50296889 (1-((1R,4R)-4-(4-methoxybenzylamino)-2,2-dimethylcyclohexanecarbonyl)-4-phenylpiperidin-4-yl)(pyrrolidin-1-yl)methanone::CHEMBL557932

SMILES: COc1ccc(CN[C@@H]2CC[C@@H](C(=O)N3CCC(CC3)(C(=O)N3CCCC3)c3ccccc3)C(C)(C)C2)cc1

InChI Key: InChIKey=AISACCGWYLBAMP-PXJZQJOASA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50296889   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50296889
PNG
((1-((1R,4R)-4-(4-methoxybenzylamino)-2,2-dimethylc...)
Show SMILES COc1ccc(CN[C@@H]2CC[C@@H](C(=O)N3CCC(CC3)(C(=O)N3CCCC3)c3ccccc3)C(C)(C)C2)cc1 |r|
Show InChI InChI=1S/C33H45N3O3/c1-32(2)23-27(34-24-25-11-14-28(39-3)15-12-25)13-16-29(32)30(37)35-21-17-33(18-22-35,26-9-5-4-6-10-26)31(38)36-19-7-8-20-36/h4-6,9-12,14-15,27,29,34H,7-8,13,16-24H2,1-3H3/t27-,29+/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
470n/an/an/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]PYY from human recombinant neuropeptide Y1 receptor expressed in CHO (NFAT-bla) cells by scintillation counting


Bioorg Med Chem Lett 19: 4781-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.050
BindingDB Entry DOI: 10.7270/Q2319VXR
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50296889
PNG
((1-((1R,4R)-4-(4-methoxybenzylamino)-2,2-dimethylc...)
Show SMILES COc1ccc(CN[C@@H]2CC[C@@H](C(=O)N3CCC(CC3)(C(=O)N3CCCC3)c3ccccc3)C(C)(C)C2)cc1 |r|
Show InChI InChI=1S/C33H45N3O3/c1-32(2)23-27(34-24-25-11-14-28(39-3)15-12-25)13-16-29(32)30(37)35-21-17-33(18-22-35,26-9-5-4-6-10-26)31(38)36-19-7-8-20-36/h4-6,9-12,14-15,27,29,34H,7-8,13,16-24H2,1-3H3/t27-,29+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Displacement of [35S]MK499 from human ERG potassium channel expressed in HEK293 cells


Bioorg Med Chem Lett 19: 4781-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.050
BindingDB Entry DOI: 10.7270/Q2319VXR
More data for this
Ligand-Target Pair