BDBM50003944 CHEMBL3235738

SMILES: NC(=O)[C@@H]1CCCN1C(=O)CCCCN1CCN(CC1)c1cccc(Cl)c1Cl

InChI Key: InChIKey=IOKLCJAMAWQQLC-KRWDZBQOSA-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 = 50003944   

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
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50003944 (CHEMBL3235738) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)CCCCN1CCN(CC1)c1cccc(Cl)c1Cl |r| Show InChI InChI=1S/C20H28Cl2N4O2/c21-15-5-3-6-16(19(15)22)25-13-11-24(12-14-25)9-2-1-8-18(27)26-10-4-7-17(26)20(23)28/h3,5-6,17H,1-2,4,7-14H2,(H2,23,28)/t17-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in HEK293 cells after 1 hr by beta-counting				Eur J Med Chem 78: 10-22 (2014) Article DOI: 10.1016/j.ejmech.2014.03.005 BindingDB Entry DOI: 10.7270/Q2QN6899
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50003944 (CHEMBL3235738) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)CCCCN1CCN(CC1)c1cccc(Cl)c1Cl |r| Show InChI InChI=1S/C20H28Cl2N4O2/c21-15-5-3-6-16(19(15)22)25-13-11-24(12-14-25)9-2-1-8-18(27)26-10-4-7-17(26)20(23)28/h3,5-6,17H,1-2,4,7-14H2,(H2,23,28)/t17-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	113	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]-5-CT from human 5-HT7 receptor expressed in HEK293 cells after 1 hr by beta-counting				Eur J Med Chem 78: 10-22 (2014) Article DOI: 10.1016/j.ejmech.2014.03.005 BindingDB Entry DOI: 10.7270/Q2QN6899
					More data for this Ligand-Target Pair