BDBM50047135 (Terguride)1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10,10a-octahydro-indeno[7,1-f]quinolin-9-yl)-urea::CHEMBL285341

SMILES: CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](CC3=CCc4cccc2c34)N(C)C1

InChI Key: InChIKey=CTVAPGCBERCRDO-BHIYHBOVSA-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 = 50047135   

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(2) dopamine receptor (Homo sapiens (Human))	BDBM50047135 ((Terguride)1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10...) Show SMILES CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](CC3=CCc4cccc2c34)N(C)C1 |t:13| Show InChI InChI=1S/C21H29N3O/c1-4-24(5-2)21(25)22-16-12-18-17-8-6-7-14-9-10-15(20(14)17)11-19(18)23(3)13-16/h6-8,10,16,18-19H,4-5,9,11-13H2,1-3H3,(H,22,25)/t16-,18-,19-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Upjohn Laboratories Curated by ChEMBL					Assay Description Compound was tested for agonistic activity against D2 receptor from cloned CHO cells, used [3H]U-86170 as radioligand				J Med Chem 36: 1301-15 (1993) BindingDB Entry DOI: 10.7270/Q2TD9Z06
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50047135 ((Terguride)1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10...) Show SMILES CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](CC3=CCc4cccc2c34)N(C)C1 |t:13| Show InChI InChI=1S/C21H29N3O/c1-4-24(5-2)21(25)22-16-12-18-17-8-6-7-14-9-10-15(20(14)17)11-19(18)23(3)13-16/h6-8,10,16,18-19H,4-5,9,11-13H2,1-3H3,(H,22,25)/t16-,18-,19-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	0.950	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Upjohn Laboratories Curated by ChEMBL					Assay Description Compound was tested for antagonistic activity against D2 receptor from rat striatum, used [3H]raclopride as radioligand				J Med Chem 36: 1301-15 (1993) BindingDB Entry DOI: 10.7270/Q2TD9Z06
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50047135 ((Terguride)1,1-Diethyl-3-(7-methyl-4,6,6a,7,8,9,10...) Show SMILES CCN(CC)C(=O)N[C@@H]1C[C@H]2[C@@H](CC3=CCc4cccc2c34)N(C)C1 |t:13| Show InChI InChI=1S/C21H29N3O/c1-4-24(5-2)21(25)22-16-12-18-17-8-6-7-14-9-10-15(20(14)17)11-19(18)23(3)13-16/h6-8,10,16,18-19H,4-5,9,11-13H2,1-3H3,(H,22,25)/t16-,18-,19-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Upjohn Laboratories Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 1A receptor from bovine hippocampus, used [3H]8-OH-DPAT as radioligand				J Med Chem 36: 1301-15 (1993) BindingDB Entry DOI: 10.7270/Q2TD9Z06
					More data for this Ligand-Target Pair