BDBM50505720 CHEMBL4589982

SMILES: Fc1ccc(CN(NC(=O)NCCCN2CCN(CC2)c2ccc(Cl)cc2)c2ccccc2)cc1

InChI Key: InChIKey=ADKPDCJUAOTYGJ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50505720   

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
D(4) dopamine receptor (Homo sapiens (Human))	BDBM50505720 (CHEMBL4589982) Show SMILES Fc1ccc(CN(NC(=O)NCCCN2CCN(CC2)c2ccc(Cl)cc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H31ClFN5O/c28-23-9-13-25(14-10-23)33-19-17-32(18-20-33)16-4-15-30-27(35)31-34(26-5-2-1-3-6-26)21-22-7-11-24(29)12-8-22/h1-3,5-14H,4,15-21H2,(H2,30,31,35)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander-Universit£t Erlangen-N£rnberg Curated by ChEMBL					Assay Description Displacement of [3H] Spiperone from human D4.4 receptor expressed in CHO cells by competitive radioligand binding assay				J Med Chem 62: 9658-9679 (2019) Article DOI: 10.1021/acs.jmedchem.9b01085
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50505720 (CHEMBL4589982) Show SMILES Fc1ccc(CN(NC(=O)NCCCN2CCN(CC2)c2ccc(Cl)cc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H31ClFN5O/c28-23-9-13-25(14-10-23)33-19-17-32(18-20-33)16-4-15-30-27(35)31-34(26-5-2-1-3-6-26)21-22-7-11-24(29)12-8-22/h1-3,5-14H,4,15-21H2,(H2,30,31,35)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander-Universit£t Erlangen-N£rnberg Curated by ChEMBL					Assay Description Displacement of [3H] Spiperone from human D2S receptor expressed in CHO cells by competitive radioligand binding assay				J Med Chem 62: 9658-9679 (2019) Article DOI: 10.1021/acs.jmedchem.9b01085
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50505720 (CHEMBL4589982) Show SMILES Fc1ccc(CN(NC(=O)NCCCN2CCN(CC2)c2ccc(Cl)cc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H31ClFN5O/c28-23-9-13-25(14-10-23)33-19-17-32(18-20-33)16-4-15-30-27(35)31-34(26-5-2-1-3-6-26)21-22-7-11-24(29)12-8-22/h1-3,5-14H,4,15-21H2,(H2,30,31,35)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander-Universit£t Erlangen-N£rnberg Curated by ChEMBL					Assay Description Displacement of [3H] Spiperone from human D2L receptor expressed in CHO cells by competitive radioligand binding assay				J Med Chem 62: 9658-9679 (2019) Article DOI: 10.1021/acs.jmedchem.9b01085
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Homo sapiens (Human))	BDBM50505720 (CHEMBL4589982) Show SMILES Fc1ccc(CN(NC(=O)NCCCN2CCN(CC2)c2ccc(Cl)cc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H31ClFN5O/c28-23-9-13-25(14-10-23)33-19-17-32(18-20-33)16-4-15-30-27(35)31-34(26-5-2-1-3-6-26)21-22-7-11-24(29)12-8-22/h1-3,5-14H,4,15-21H2,(H2,30,31,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	850	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Friedrich-Alexander-Universit£t Erlangen-N£rnberg Curated by ChEMBL					Assay Description Displacement of [3H] Spiperone from human D3 receptor expressed in CHO cells by competitive radioligand binding assay				J Med Chem 62: 9658-9679 (2019) Article DOI: 10.1021/acs.jmedchem.9b01085
					More data for this Ligand-Target Pair