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BDBM50094495 3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-indole-5-carbonitrile::CHEMBL143355

SMILES: Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1

InChI Key: InChIKey=SNFLVHDMWFYRRB-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 = 50094495   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50094495
PNG
(3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-in...)
Show SMILES Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C20H19ClN4/c21-18-3-1-2-4-20(18)25-9-7-24(8-10-25)14-16-13-23-19-6-5-15(12-22)11-17(16)19/h1-6,11,13,23H,7-10,14H2
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Article
PubMed
17n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human Dopamine receptor D4.4 expressed in CHO cells


J Med Chem 43: 4563-9 (2000)


Article DOI: 10.1021/jm0009989
BindingDB Entry DOI: 10.7270/Q2736RM8
More data for this
Ligand-Target Pair
DRD1


(BOVINE)
BDBM50094495
PNG
(3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-in...)
Show SMILES Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C20H19ClN4/c21-18-3-1-2-4-20(18)25-9-7-24(8-10-25)14-16-13-23-19-6-5-15(12-22)11-17(16)19/h1-6,11,13,23H,7-10,14H2
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UniProtKB/SwissProt

GoogleScholar
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PC sid
UniChem

Similars

Article
PubMed
510n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH-23390 from Dopamine receptor D1 of bovine striatal membranes


J Med Chem 43: 4563-9 (2000)


Article DOI: 10.1021/jm0009989
BindingDB Entry DOI: 10.7270/Q2736RM8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50094495
PNG
(3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-in...)
Show SMILES Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C20H19ClN4/c21-18-3-1-2-4-20(18)25-9-7-24(8-10-25)14-16-13-23-19-6-5-15(12-22)11-17(16)19/h1-6,11,13,23H,7-10,14H2
PDB

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PC sid
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Article
PubMed
540n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human Dopamine receptor D2S expressed in CHO cells


J Med Chem 43: 4563-9 (2000)


Article DOI: 10.1021/jm0009989
BindingDB Entry DOI: 10.7270/Q2736RM8
More data for this
Ligand-Target Pair
D2-like dopamine receptor


(Homo sapiens (Human))
BDBM50094495
PNG
(3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-in...)
Show SMILES Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C20H19ClN4/c21-18-3-1-2-4-20(18)25-9-7-24(8-10-25)14-16-13-23-19-6-5-15(12-22)11-17(16)19/h1-6,11,13,23H,7-10,14H2
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
550n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human Dopamine receptor D3 expressed in CHO cells


J Med Chem 43: 4563-9 (2000)


Article DOI: 10.1021/jm0009989
BindingDB Entry DOI: 10.7270/Q2736RM8
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50094495
PNG
(3-[4-(2-Chloro-phenyl)-piperazin-1-ylmethyl]-1H-in...)
Show SMILES Clc1ccccc1N1CCN(Cc2c[nH]c3ccc(cc23)C#N)CC1
Show InChI InChI=1S/C20H19ClN4/c21-18-3-1-2-4-20(18)25-9-7-24(8-10-25)14-16-13-23-19-6-5-15(12-22)11-17(16)19/h1-6,11,13,23H,7-10,14H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human Dopamine receptor D2L expressed in CHO cells


J Med Chem 43: 4563-9 (2000)


Article DOI: 10.1021/jm0009989
BindingDB Entry DOI: 10.7270/Q2736RM8
More data for this
Ligand-Target Pair