BDBM50233624 CHEMBL4093980

SMILES: Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl

InChI Key: InChIKey=WBEWCMPWKAJVJV-UHFFFAOYSA-N

Data: 4 KI  2 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 6 hits for monomerid = 50233624   

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 2A (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from human 5-HT2A receptor expressed in F1pIn CHO cell membranes after 1 hr by scintillation counting method				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	76	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from human 5-HT2A receptor expressed in F1pIn CHO cell membranes after 1 hr by scintillation counting method				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	273	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]-raclopride from human dopamine D2L receptor expressed in F1pIn CHO cells after 60 mins by scintillation counting analysis				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	275	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]-raclopride from human dopamine D2L receptor expressed in F1pIn CHO cells after 60 mins by scintillation counting analysis				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human mAChR1 receptor expressed in F1pIn CHO cells after 60 mins by scintillation counting analysis				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM50233624 (CHEMBL4093980) Show SMILES Clc1cccc(N2CCN(CCCN3C(=O)COc4ccccc34)CC2)c1Cl Show InChI InChI=1S/C21H23Cl2N3O2/c22-16-5-3-7-18(21(16)23)25-13-11-24(12-14-25)9-4-10-26-17-6-1-2-8-19(17)28-15-20(26)27/h1-3,5-8H,4,9-15H2	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human mAChR1 receptor expressed in F1pIn CHO cells after 60 mins by scintillation counting analysis				J Med Chem 58: 1550-5 (2015) BindingDB Entry DOI: 10.7270/Q2F76FTG
					More data for this Ligand-Target Pair