BindingDB logo
myBDB logout

BDBM50122798 1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidazol-2-yl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one::CHEMBL318735

SMILES: Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1

InChI Key: InChIKey=FFQNIRWMHOFXPG-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 = 50122798   
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
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50122798
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidaz...)
Show SMILES Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN6O/c1-32-14-10-30-27(32)21-2-7-26-24(18-21)25(19-35(26)23-5-3-22(29)4-6-23)20-8-12-33(13-9-20)16-17-34-15-11-31-28(34)36/h2-7,10,14,18-20H,8-9,11-13,15-17H2,1H3,(H,31,36)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.30n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Ability to displace [3H]5-CT (2.0 nM) from HeLa cells of human 5-hydroxytryptamine 1A receptor


J Med Chem 46: 265-83 (2003)


Article DOI: 10.1021/jm020938y
BindingDB Entry DOI: 10.7270/Q2TB17MV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (Human))
BDBM50122798
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidaz...)
Show SMILES Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN6O/c1-32-14-10-30-27(32)21-2-7-26-24(18-21)25(19-35(26)23-5-3-22(29)4-6-23)20-8-12-33(13-9-20)16-17-34-15-11-31-28(34)36/h2-7,10,14,18-20H,8-9,11-13,15-17H2,1H3,(H,31,36)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Ability to displace [3H]5-CT (1.5 nM) from HeLa cells of human 5-hydroxytryptamine 1B receptor


J Med Chem 46: 265-83 (2003)


Article DOI: 10.1021/jm020938y
BindingDB Entry DOI: 10.7270/Q2TB17MV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50122798
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidaz...)
Show SMILES Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN6O/c1-32-14-10-30-27(32)21-2-7-26-24(18-21)25(19-35(26)23-5-3-22(29)4-6-23)20-8-12-33(13-9-20)16-17-34-15-11-31-28(34)36/h2-7,10,14,18-20H,8-9,11-13,15-17H2,1H3,(H,31,36)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
22n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin (0.5 nM) from rat cerebral cortex 5-hydroxytryptamine 2A receptors


J Med Chem 46: 265-83 (2003)


Article DOI: 10.1021/jm020938y
BindingDB Entry DOI: 10.7270/Q2TB17MV
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50122798
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidaz...)
Show SMILES Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN6O/c1-32-14-10-30-27(32)21-2-7-26-24(18-21)25(19-35(26)23-5-3-22(29)4-6-23)20-8-12-33(13-9-20)16-17-34-15-11-31-28(34)36/h2-7,10,14,18-20H,8-9,11-13,15-17H2,1H3,(H,31,36)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
130n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine (0.5 nM) from rat 5-hydroxytryptamine 2C receptor expressed in SR-3T3 cells


J Med Chem 46: 265-83 (2003)


Article DOI: 10.1021/jm020938y
BindingDB Entry DOI: 10.7270/Q2TB17MV
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50122798
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-imidaz...)
Show SMILES Cn1ccnc1-c1ccc2n(cc(C3CCN(CCN4CCNC4=O)CC3)c2c1)-c1ccc(F)cc1
Show InChI InChI=1S/C28H31FN6O/c1-32-14-10-30-27(32)21-2-7-26-24(18-21)25(19-35(26)23-5-3-22(29)4-6-23)20-8-12-33(13-9-20)16-17-34-15-11-31-28(34)36/h2-7,10,14,18-20H,8-9,11-13,15-17H2,1H3,(H,31,36)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
200n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone (0.5 nM) from rat corpus striatum dopamine D2 receptor


J Med Chem 46: 265-83 (2003)


Article DOI: 10.1021/jm020938y
BindingDB Entry DOI: 10.7270/Q2TB17MV
More data for this
Ligand-Target Pair