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BDBM50028978 1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-methyl-piperidine::CHEMBL269396

SMILES: CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12

InChI Key: InChIKey=AENACYRRZFSOSG-UHFFFAOYSA-N

Data: 5 KI  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 7 hits for monomerid = 50028978   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity of the compound was evaluated as inhibition constant for serotonin 5-hydroxytryptamine 3 receptor


J Med Chem 37: 2686-96 (1994)


Article DOI: 10.1021/jm00043a008
BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
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Article
PubMed
1.00E+3n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity was evaluated as inhibition constant for dopamine D-4 receptor


J Med Chem 37: 2686-96 (1994)


Article DOI: 10.1021/jm00043a008
BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
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>1.00E+3n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity was evaluated as inhibition constant for serotonin 5-hydroxytryptamine 2A receptor


J Med Chem 37: 2686-96 (1994)


Article DOI: 10.1021/jm00043a008
BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity was evaluated as inhibition constant for serotonin 5-hydroxytryptamine 2C receptor


J Med Chem 37: 2686-96 (1994)


Article DOI: 10.1021/jm00043a008
BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
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Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Affinity was evaluated as inhibition constant for dopamine D-2 receptor


J Med Chem 37: 2686-96 (1994)


Article DOI: 10.1021/jm00043a008
BindingDB Entry DOI: 10.7270/Q28051NX
More data for this
Ligand-Target Pair
Dopamine receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
MMDB

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n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Relative affinity for dopamine receptor by displacement of [3H]spiroperidol (2.2 nM) from (in vitro) dopamine binding sites in rat caudate nuclei


J Med Chem 24: 1021-6 (1981)


Article DOI: 10.1021/jm00141a001
BindingDB Entry DOI: 10.7270/Q2348NKF
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50028978
PNG
(1-(2-Chloro-5H-dibenzo[a,d]cyclohepten-10-yl)-4-me...)
Show SMILES CC1CCN(CC1)C1=Cc2cc(Cl)ccc2Cc2ccccc12
Show InChI InChI=1S/C21H22ClN/c1-15-8-10-23(11-9-15)21-14-18-13-19(22)7-6-16(18)12-17-4-2-3-5-20(17)21/h2-7,13-15H,8-12H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Concentration required (in vitro) to displace 50% specific binding of [3H]clozapine to Muscarinic acetylcholine receptor in rat brain


J Med Chem 24: 1021-6 (1981)


Article DOI: 10.1021/jm00141a001
BindingDB Entry DOI: 10.7270/Q2348NKF
More data for this
Ligand-Target Pair