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BDBM50295257 (R)-N-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)picolinamide::CHEMBL551051

SMILES: Clc1ccc2[nH]c3[C@@H](CCCc3c2c1)NC(=O)c1ccccn1

InChI Key: InChIKey=WJQBOBGVBBZLJU-OAHLLOKOSA-N

Data: 1 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50295257   
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
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50295257
PNG
((R)-N-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-y...)
Show SMILES Clc1ccc2[nH]c3[C@@H](CCCc3c2c1)NC(=O)c1ccccn1 |r|
Show InChI InChI=1S/C18H16ClN3O/c19-11-7-8-14-13(10-11)12-4-3-6-15(17(12)21-14)22-18(23)16-5-1-2-9-20-16/h1-2,5,7-10,15,21H,3-4,6H2,(H,22,23)/t15-/m1/s1
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Article
PubMed
203n/an/an/an/an/an/an/an/a



University of Turin (UniTo)

Curated by ChEMBL


Assay Description
Inhibition of human DHODH


Eur J Med Chem 183: (2019)


Article DOI: 10.1016/j.ejmech.2019.111681
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Homo sapiens (Human))
BDBM50295257
PNG
((R)-N-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-y...)
Show SMILES Clc1ccc2[nH]c3[C@@H](CCCc3c2c1)NC(=O)c1ccccn1 |r|
Show InChI InChI=1S/C18H16ClN3O/c19-11-7-8-14-13(10-11)12-4-3-6-15(17(12)21-14)22-18(23)16-5-1-2-9-20-16/h1-2,5,7-10,15,21H,3-4,6H2,(H,22,23)/t15-/m1/s1
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Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline Research& Development

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


Bioorg Med Chem Lett 19: 4110-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.001
BindingDB Entry DOI: 10.7270/Q27944RX
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50295257
PNG
((R)-N-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-y...)
Show SMILES Clc1ccc2[nH]c3[C@@H](CCCc3c2c1)NC(=O)c1ccccn1 |r|
Show InChI InChI=1S/C18H16ClN3O/c19-11-7-8-14-13(10-11)12-4-3-6-15(17(12)21-14)22-18(23)16-5-1-2-9-20-16/h1-2,5,7-10,15,21H,3-4,6H2,(H,22,23)/t15-/m1/s1
PDB
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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



GlaxoSmithKline Research& Development

Curated by ChEMBL


Assay Description
Inhibition of human ERG


Bioorg Med Chem Lett 19: 4110-4 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.001
BindingDB Entry DOI: 10.7270/Q27944RX
More data for this
Ligand-Target Pair