BDBM50108500 2-Methyl-furan-3-carboxylic acid [4-(methyl-{4-methyl-2-[6-(4-methyl-piperazin-1-yl)-6-oxo-hexyloxy]-phenyl}-carbamoyl)-phenyl]-amide::CHEMBL74593

SMILES: CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1

InChI Key: InChIKey=HLSBJGNMECMRGP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50108500   

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
AVPR1A (RAT)	BDBM50108500 (2-Methyl-furan-3-carboxylic acid [4-(methyl-{4-met...) Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1 Show InChI InChI=1S/C32H40N4O5/c1-23-9-14-28(29(22-23)41-20-7-5-6-8-30(37)36-18-16-34(3)17-19-36)35(4)32(39)25-10-12-26(13-11-25)33-31(38)27-15-21-40-24(27)2/h9-15,21-22H,5-8,16-20H2,1-4H3,(H,33,38)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yamanouchi Pharmaceutical Co. Ltd. Curated by ChEMBL					Assay Description Evaluated for the binding affinity towards vasopressin (V1A) receptor in rat liver membrane using [3H]AVP as radioligand				Bioorg Med Chem Lett 12: 229-32 (2001) BindingDB Entry DOI: 10.7270/Q2R78FQP
					More data for this Ligand-Target Pair
Vasopressin V2 Receptor (Rattus norvegicus (Rat))	BDBM50108500 (2-Methyl-furan-3-carboxylic acid [4-(methyl-{4-met...) Show SMILES CN(C(=O)c1ccc(NC(=O)c2ccoc2C)cc1)c1ccc(C)cc1OCCCCCC(=O)N1CCN(C)CC1 Show InChI InChI=1S/C32H40N4O5/c1-23-9-14-28(29(22-23)41-20-7-5-6-8-30(37)36-18-16-34(3)17-19-36)35(4)32(39)25-10-12-26(13-11-25)33-31(38)27-15-21-40-24(27)2/h9-15,21-22H,5-8,16-20H2,1-4H3,(H,33,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	73	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yamanouchi Pharmaceutical Co. Ltd. Curated by ChEMBL					Assay Description Evaluated for the binding affinity towards vasopressin (V2) receptor in rat kidney membrane using [3H]AVP as radioligand				Bioorg Med Chem Lett 12: 229-32 (2001) BindingDB Entry DOI: 10.7270/Q2R78FQP
					More data for this Ligand-Target Pair