BDBM50382313 CHEMBL2024518

SMILES: CCNC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1

InChI Key: InChIKey=QNTHRQYZEIGUHC-QAQDUYKDSA-N

Data: 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 2 hits for monomerid = 50382313   

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(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50382313 (CHEMBL2024518) Show SMILES CCNC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:6.5,wD:9.9,(-2.58,-11.25,;-1.25,-10.48,;-1.25,-8.94,;.09,-8.17,;.09,-6.63,;1.42,-8.95,;2.75,-8.17,;2.75,-6.63,;4.08,-5.86,;5.41,-6.63,;6.75,-5.87,;8.08,-6.64,;9.41,-5.88,;10.74,-6.66,;12.07,-5.9,;12.09,-4.36,;10.75,-3.58,;9.41,-4.34,;13.43,-3.56,;14.76,-4.34,;16.1,-3.56,;16.1,-2.01,;14.76,-1.25,;14.77,.29,;13.44,-2.02,;12.09,-1.24,;5.41,-8.17,;4.08,-8.94,)| Show InChI InChI=1S/C21H32Cl2N4O/c1-2-24-21(28)25-17-8-6-16(7-9-17)10-11-26-12-14-27(15-13-26)19-5-3-4-18(22)20(19)23/h3-5,16-17H,2,6-15H2,1H3,(H2,24,25,28)/t16-,17-	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.340	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from rat recombinant dopamine D3 receptor expressed in Sf9 cells				Bioorg Med Chem Lett 22: 3437-40 (2012) Article DOI: 10.1016/j.bmcl.2012.03.104 BindingDB Entry DOI: 10.7270/Q2ZW1MZN
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50382313 (CHEMBL2024518) Show SMILES CCNC(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |r,wU:6.5,wD:9.9,(-2.58,-11.25,;-1.25,-10.48,;-1.25,-8.94,;.09,-8.17,;.09,-6.63,;1.42,-8.95,;2.75,-8.17,;2.75,-6.63,;4.08,-5.86,;5.41,-6.63,;6.75,-5.87,;8.08,-6.64,;9.41,-5.88,;10.74,-6.66,;12.07,-5.9,;12.09,-4.36,;10.75,-3.58,;9.41,-4.34,;13.43,-3.56,;14.76,-4.34,;16.1,-3.56,;16.1,-2.01,;14.76,-1.25,;14.77,.29,;13.44,-2.02,;12.09,-1.24,;5.41,-8.17,;4.08,-8.94,)| Show InChI InChI=1S/C21H32Cl2N4O/c1-2-24-21(28)25-17-8-6-16(7-9-17)10-11-26-12-14-27(15-13-26)19-5-3-4-18(22)20(19)23/h3-5,16-17H,2,6-15H2,1H3,(H2,24,25,28)/t16-,17-	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16.9	n/a	n/a	n/a	n/a	n/a	n/a
Gedeon Richter Plc Curated by ChEMBL					Assay Description Displacement of [3H]spiperone from dopamine D2 receptor in rat striatal membranes				Bioorg Med Chem Lett 22: 3437-40 (2012) Article DOI: 10.1016/j.bmcl.2012.03.104 BindingDB Entry DOI: 10.7270/Q2ZW1MZN
					More data for this Ligand-Target Pair