BDBM50035313 8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-benzo[e]indole-1-carbonitrile::CHEMBL71474

SMILES: CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1

InChI Key: InChIKey=YNVHOSVITIKRBS-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50035313   

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))	BDBM50035313 (8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-ben...) Show SMILES CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1 Show InChI InChI=1S/C19H24FN3/c1-3-7-23(8-4-2)15-6-5-13-9-17(20)19-18(16(13)10-15)14(11-21)12-22-19/h9,12,15,22H,3-8,10H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Göteborg University Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 1A receptor from CHO-K1 cells, using [3H]-8-OH-DPAT as the radioligand.				J Med Chem 38: 2202-16 (1995) BindingDB Entry DOI: 10.7270/Q24T6HD0
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50035313 (8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-ben...) Show SMILES CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1 Show InChI InChI=1S/C19H24FN3/c1-3-7-23(8-4-2)15-6-5-13-9-17(20)19-18(16(13)10-15)14(11-21)12-22-19/h9,12,15,22H,3-8,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	8.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Göteborg University Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 1D receptor alpha expressed in CHO-K1 cells, using [3H]-5-HT as the radioligand.				J Med Chem 38: 2202-16 (1995) BindingDB Entry DOI: 10.7270/Q24T6HD0
					More data for this Ligand-Target Pair
D(3) dopamine receptor (Rattus norvegicus (Rat))	BDBM50035313 (8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-ben...) Show SMILES CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1 Show InChI InChI=1S/C19H24FN3/c1-3-7-23(8-4-2)15-6-5-13-9-17(20)19-18(16(13)10-15)14(11-21)12-22-19/h9,12,15,22H,3-8,10H2,1-2H3	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Göteborg University Curated by ChEMBL					Assay Description Binding affinity against Dopamine receptor D3 from CHO-K1 cells, using [3H]-spiperone as the radioligand.				J Med Chem 38: 2202-16 (1995) BindingDB Entry DOI: 10.7270/Q24T6HD0
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50035313 (8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-ben...) Show SMILES CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1 Show InChI InChI=1S/C19H24FN3/c1-3-7-23(8-4-2)15-6-5-13-9-17(20)19-18(16(13)10-15)14(11-21)12-22-19/h9,12,15,22H,3-8,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Göteborg University Curated by ChEMBL					Assay Description Binding affinity against Dopamine receptor D2 from CHO-K1 cells, using [3H]-U-86,170 as the radioligand.				J Med Chem 38: 2202-16 (1995) BindingDB Entry DOI: 10.7270/Q24T6HD0
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50035313 (8-Dipropylamino-4-fluoro-6,7,8,9-tetrahydro-3H-ben...) Show SMILES CCCN(CCC)C1CCc2cc(F)c3[nH]cc(C#N)c3c2C1 Show InChI InChI=1S/C19H24FN3/c1-3-7-23(8-4-2)15-6-5-13-9-17(20)19-18(16(13)10-15)14(11-21)12-22-19/h9,12,15,22H,3-8,10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	121	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Göteborg University Curated by ChEMBL					Assay Description Binding affinity against 5-hydroxytryptamine 1D receptor beta expressed in CHO-K1 cells, using [3H]-5-HT as the radioligand.				J Med Chem 38: 2202-16 (1995) BindingDB Entry DOI: 10.7270/Q24T6HD0
					More data for this Ligand-Target Pair