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BDBM82439 Adinazolam::CAS_37115-32-5::NSC_37632

SMILES: CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12

InChI Key: InChIKey=GJSLOMWRLALDCT-UHFFFAOYSA-N

Data: 11 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 11 hits for monomerid = 82439   
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))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
CHRM5


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Foundation

Curated by PDSP Ki Database




Biochem Pharmacol 45: 2352-4 (1993)


Article DOI: 10.1002/cbic.201500119
BindingDB Entry DOI: 10.7270/Q2F76B2C
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
PDB

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



Mayo Foundation

Curated by PDSP Ki Database




Biochem Pharmacol 45: 2352-4 (1993)


Article DOI: 10.1002/cbic.201500119
BindingDB Entry DOI: 10.7270/Q2F76B2C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
Reactome pathway
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Foundation

Curated by PDSP Ki Database




Biochem Pharmacol 45: 2352-4 (1993)


Article DOI: 10.1002/cbic.201500119
BindingDB Entry DOI: 10.7270/Q2F76B2C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
Reactome pathway
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Mayo Foundation

Curated by PDSP Ki Database




Biochem Pharmacol 45: 2352-4 (1993)


Article DOI: 10.1002/cbic.201500119
BindingDB Entry DOI: 10.7270/Q2F76B2C
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM82439
PNG
(Adinazolam | CAS_37115-32-5 | NSC_37632)
Show SMILES CN(C)Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12
Show InChI InChI=1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
PDB

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



Mayo Clinic

Curated by PDSP Ki Database




Psychopharmacology (Berl) 114: 559-65 (1994)


Article DOI: 10.1016/j.bioorg.2014.11.006
BindingDB Entry DOI: 10.7270/Q25X27FZ
More data for this
Ligand-Target Pair