BDBM50007684 CHEMBL3233413

SMILES: [H][C@]12CCN(CCCc3n[nH]c4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13

InChI Key: InChIKey=RSNYLBGZLKEOAP-UGKGYDQZSA-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 = 50007684   

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))	BDBM50007684 (CHEMBL3233413) Show SMILES [H][C@]12CCN(CCCc3n[nH]c4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r| Show InChI InChI=1S/C24H28FN5/c1-28-12-13-30-22-9-11-29(15-19(22)17-4-2-6-23(28)24(17)30)10-3-5-20-18-8-7-16(25)14-21(18)27-26-20/h2,4,6-8,14,19,22H,3,5,9-13,15H2,1H3,(H,26,27)/t19-,22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Intra-Cellular Therapies, Inc. Curated by ChEMBL					Assay Description Displacement of [125]DOI from human recombinant full length 5HT2A receptor expressed in HEK293E cells				J Med Chem 57: 2670-82 (2014) Article DOI: 10.1021/jm401958n BindingDB Entry DOI: 10.7270/Q27D2WNZ
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50007684 (CHEMBL3233413) Show SMILES [H][C@]12CCN(CCCc3n[nH]c4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r| Show InChI InChI=1S/C24H28FN5/c1-28-12-13-30-22-9-11-29(15-19(22)17-4-2-6-23(28)24(17)30)10-3-5-20-18-8-7-16(25)14-21(18)27-26-20/h2,4,6-8,14,19,22H,3,5,9-13,15H2,1H3,(H,26,27)/t19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Intra-Cellular Therapies, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-N-methylspiperone from rat recombinant dopamine D2 short receptor expressed in CHO cells				J Med Chem 57: 2670-82 (2014) Article DOI: 10.1021/jm401958n BindingDB Entry DOI: 10.7270/Q27D2WNZ
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50007684 (CHEMBL3233413) Show SMILES [H][C@]12CCN(CCCc3n[nH]c4cc(F)ccc34)C[C@@]1([H])c1cccc3N(C)CCN2c13 |r| Show InChI InChI=1S/C24H28FN5/c1-28-12-13-30-22-9-11-29(15-19(22)17-4-2-6-23(28)24(17)30)10-3-5-20-18-8-7-16(25)14-21(18)27-26-20/h2,4,6-8,14,19,22H,3,5,9-13,15H2,1H3,(H,26,27)/t19-,22-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Intra-Cellular Therapies, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]-N-methyl-citalopram from SERT in human platelets after 60 mins by liquid scintillation counting analysis				J Med Chem 57: 2670-82 (2014) Article DOI: 10.1021/jm401958n BindingDB Entry DOI: 10.7270/Q27D2WNZ
					More data for this Ligand-Target Pair