BDBM50082817 4-(3,4-Difluoro-phenyl)-3-[3-(4,4-diphenyl-piperidin-1-yl)-propylcarbamoyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid methyl ester::CHEMBL144989

SMILES: COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)(c1ccccc1)c1ccccc1

InChI Key: InChIKey=CHKOUYJMMIYLHA-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50082817   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Alpha-1A adrenergic receptor (Homo sapiens (Human))	BDBM50082817 (4-(3,4-Difluoro-phenyl)-3-[3-(4,4-diphenyl-piperid...) Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)(c1ccccc1)c1ccccc1 |c:4| Show InChI InChI=1S/C34H36F2N4O4/c1-23-29(31(41)44-2)30(24-14-15-27(35)28(36)22-24)40(33(43)38-23)32(42)37-18-9-19-39-20-16-34(17-21-39,25-10-5-3-6-11-25)26-12-7-4-8-13-26/h3-8,10-15,22,30H,9,16-21H2,1-2H3,(H,37,42)(H,38,43)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Synaptic Pharmaceutical Corporation Curated by ChEMBL					Assay Description In vitro binding affinity against alpha-1A adrenergic receptor of human liver microsomes				J Med Chem 42: 4778-93 (1999) BindingDB Entry DOI: 10.7270/Q2930SCW
					More data for this Ligand-Target Pair
Adrenergic alpha1B (Homo sapiens (Human))	BDBM50082817 (4-(3,4-Difluoro-phenyl)-3-[3-(4,4-diphenyl-piperid...) Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)(c1ccccc1)c1ccccc1 |c:4| Show InChI InChI=1S/C34H36F2N4O4/c1-23-29(31(41)44-2)30(24-14-15-27(35)28(36)22-24)40(33(43)38-23)32(42)37-18-9-19-39-20-16-34(17-21-39,25-10-5-3-6-11-25)26-12-7-4-8-13-26/h3-8,10-15,22,30H,9,16-21H2,1-2H3,(H,37,42)(H,38,43)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Synaptic Pharmaceutical Corporation Curated by ChEMBL					Assay Description In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.				J Med Chem 42: 4778-93 (1999) BindingDB Entry DOI: 10.7270/Q2930SCW
					More data for this Ligand-Target Pair
Alpha-1D adrenergic receptor (Homo sapiens (Human))	BDBM50082817 (4-(3,4-Difluoro-phenyl)-3-[3-(4,4-diphenyl-piperid...) Show SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC(CC1)(c1ccccc1)c1ccccc1 |c:4| Show InChI InChI=1S/C34H36F2N4O4/c1-23-29(31(41)44-2)30(24-14-15-27(35)28(36)22-24)40(33(43)38-23)32(42)37-18-9-19-39-20-16-34(17-21-39,25-10-5-3-6-11-25)26-12-7-4-8-13-26/h3-8,10-15,22,30H,9,16-21H2,1-2H3,(H,37,42)(H,38,43)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Synaptic Pharmaceutical Corporation Curated by ChEMBL					Assay Description In vitro binding affinity against alpha-1D adrenergic receptor of human liver microsomes.				J Med Chem 42: 4778-93 (1999) BindingDB Entry DOI: 10.7270/Q2930SCW
					More data for this Ligand-Target Pair