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BDBM50069083 (5bR,9aR)-1,5b-Dimethyl-4-trifluoromethyl-1,5b,6,7,8,9,9a,10-octahydro-pyrido[2,3-b]carbazol-2-one::CHEMBL422196

SMILES: Cn1c2cc3N[C@@H]4CCCC[C@]4(C)c3cc2c(cc1=O)C(F)(F)F

InChI Key: InChIKey=CKEHLASBWDDIJA-NVXWUHKLSA-N

Data: 1 KI  1 EC50

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 = 50069083   
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
Androgen receptor


(Homo sapiens (Human))
BDBM50069083
PNG
((5bR,9aR)-1,5b-Dimethyl-4-trifluoromethyl-1,5b,6,7...)
Show SMILES Cn1c2cc3N[C@@H]4CCCC[C@]4(C)c3cc2c(cc1=O)C(F)(F)F
Show InChI InChI=1S/C18H19F3N2O/c1-17-6-4-3-5-15(17)22-13-9-14-10(7-12(13)17)11(18(19,20)21)8-16(24)23(14)2/h7-9,15,22H,3-6H2,1-2H3/t15-,17-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
9n/an/an/an/an/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against Androgen receptor transfected into COS cells


Bioorg Med Chem Lett 8: 745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2XS5THG
More data for this
Ligand-Target Pair
Androgen receptor


(Homo sapiens (Human))
BDBM50069083
PNG
((5bR,9aR)-1,5b-Dimethyl-4-trifluoromethyl-1,5b,6,7...)
Show SMILES Cn1c2cc3N[C@@H]4CCCC[C@]4(C)c3cc2c(cc1=O)C(F)(F)F
Show InChI InChI=1S/C18H19F3N2O/c1-17-6-4-3-5-15(17)22-13-9-14-10(7-12(13)17)11(18(19,20)21)8-16(24)23(14)2/h7-9,15,22H,3-6H2,1-2H3/t15-,17-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 33n/an/an/an/a



Ligand Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against hAR androgen receptor expressed in COS cells


Bioorg Med Chem Lett 8: 745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2XS5THG
More data for this
Ligand-Target Pair