BDBM50218395 CHEMBL311095

SMILES: O=C(NC1CCN(CCCCc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2

InChI Key: InChIKey=NBMHNTBSWCLRKZ-UHFFFAOYSA-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 = 50218395   

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 (Rattus norvegicus (rat))	BDBM50218395 (CHEMBL311095) Show SMILES O=C(NC1CCN(CCCCc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 |TLB:25:24:27:19.20.21,25:20:27:26.24.23,THB:23:24:19:27.22.21,23:22:19:26.24.25| Show InChI InChI=1S/C25H36N2O/c28-24(25-15-20-12-21(16-25)14-22(13-20)17-25)26-23-9-11-27(18-23)10-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,20-23H,4-5,8-18H2,(H,26,28)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Welfide Corporation Curated by ChEMBL					Assay Description Binding affinity at 5-hydroxytryptamine 1A receptor from striata of wistar rats by [3H]- 8-OH -DPAT displacement.				Bioorg Med Chem Lett 10: 2457-61 (2001) BindingDB Entry DOI: 10.7270/Q2VT1SN2
					More data for this Ligand-Target Pair
Serotonin 2 (5-HT2) receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50218395 (CHEMBL311095) Show SMILES O=C(NC1CCN(CCCCc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 |TLB:25:24:27:19.20.21,25:20:27:26.24.23,THB:23:24:19:27.22.21,23:22:19:26.24.25| Show InChI InChI=1S/C25H36N2O/c28-24(25-15-20-12-21(16-25)14-22(13-20)17-25)26-23-9-11-27(18-23)10-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,20-23H,4-5,8-18H2,(H,26,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Welfide Corporation Curated by ChEMBL					Assay Description Binding affinity at 5-hydroxytryptamine 2 receptor from striata wistar rats by [3H]ketanserin displacement.				Bioorg Med Chem Lett 10: 2457-61 (2001) BindingDB Entry DOI: 10.7270/Q2VT1SN2
					More data for this Ligand-Target Pair
Adrenergic receptor alpha-1 (Homo sapiens (Human))	BDBM50218395 (CHEMBL311095) Show SMILES O=C(NC1CCN(CCCCc2ccccc2)C1)C12CC3CC(CC(C3)C1)C2 |TLB:25:24:27:19.20.21,25:20:27:26.24.23,THB:23:24:19:27.22.21,23:22:19:26.24.25| Show InChI InChI=1S/C25H36N2O/c28-24(25-15-20-12-21(16-25)14-22(13-20)17-25)26-23-9-11-27(18-23)10-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,20-23H,4-5,8-18H2,(H,26,28)	MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Welfide Corporation Curated by ChEMBL					Assay Description Ability to displace [3H]-Prazosin binding to Alpha-1 adrenergic receptor				Bioorg Med Chem Lett 10: 2457-61 (2001) BindingDB Entry DOI: 10.7270/Q2VT1SN2
					More data for this Ligand-Target Pair