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SMILES: [H][C@@]12C[C@H](CC)[C@@]3([H])C(C1)c1[nH]c4ccc(O)cc4c1CCN3C2

InChI Key:

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 2 hits for monomerid = 50597219   
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
Synaptic vesicular amine transporter


(Rattus norvegicus (Rat))
BDBM50597219
PNG
(CHEMBL5202868)
Show SMILES [H][C@@]12C[C@H](CC)[C@@]3([H])C(C1)c1[nH]c4ccc(O)cc4c1CCN3C2 |r,TLB:2:1:6:19.10.21.20,18:19:9.1.23:6,11:10:9.1.23:6,THB:4:3:8.9:23.22,21:22:8.9:3.2,10:8:23.22:3.2|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 570n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acsmedchemlett.2c00214
BindingDB Entry DOI: 10.7270/Q2BR8X66
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50597219
PNG
(CHEMBL5202868)
Show SMILES [H][C@@]12C[C@H](CC)[C@@]3([H])C(C1)c1[nH]c4ccc(O)cc4c1CCN3C2 |r,TLB:2:1:6:19.10.21.20,18:19:9.1.23:6,11:10:9.1.23:6,THB:4:3:8.9:23.22,21:22:8.9:3.2,10:8:23.22:3.2|
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 280n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acsmedchemlett.2c00214
BindingDB Entry DOI: 10.7270/Q2BR8X66
More data for this
Ligand-Target Pair