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BDBM50211776 CHEMBL226030::CHEMBL376349::{(2S)-2-hydroxy-2-[(1R,2S,7S,8S,9S)-3,3,7-trimethyltricyclo[5.4.0.02,9]undec-8-yl]ethyl}phosphonic acid

SMILES: C[C@]12CCCC(C)(C)[C@H]3[C@H](CC[C@@H]13)[C@@H]2C(=O)CP(O)(O)O

InChI Key: InChIKey=FFNLTZUBTRHSOJ-PFPHFSHZSA-N

Data: 2 IC50

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 = 50211776   
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
Uridine-5'-diphosphoglucuronosyltransferase 2B7


(Homo sapiens (Human))
BDBM50211776
PNG
(CHEMBL226030 | CHEMBL376349 | {(2S)-2-hydroxy-2-[(...)
Show SMILES C[C@]12CCCC(C)(C)[C@H]3[C@H](CC[C@@H]13)[C@@H]2C(=O)CP(O)(O)O |TLB:2:1:10.11:8,0:1:10.11:8,THB:11:12:9.13:2.3.5.4,5:8:10.11:13.1,14:13:10.11:8|
Show InChI InChI=1S/C16H29O4P/c1-15(2)7-4-8-16(3)11-6-5-10(13(11)15)14(16)12(17)9-21(18,19)20/h10-11,13-14,18-21H,4-9H2,1-3H3/t10-,11+,13-,14+,16-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



University of Helsinki

Curated by ChEMBL


Assay Description
Inhibition of human UGT2B7 assessed as reduction of estriol glucuronidation


J Med Chem 50: 2655-64 (2007)


Article DOI: 10.1021/jm061204e
BindingDB Entry DOI: 10.7270/Q23F4QF2
More data for this
Ligand-Target Pair
Uridine-5'-diphosphoglucuronosyltransferase 2B7


(Homo sapiens (Human))
BDBM50211776
PNG
(CHEMBL226030 | CHEMBL376349 | {(2S)-2-hydroxy-2-[(...)
Show SMILES C[C@]12CCCC(C)(C)[C@H]3[C@H](CC[C@@H]13)[C@@H]2C(=O)CP(O)(O)O |TLB:2:1:10.11:8,0:1:10.11:8,THB:11:12:9.13:2.3.5.4,5:8:10.11:13.1,14:13:10.11:8|
Show InChI InChI=1S/C16H29O4P/c1-15(2)7-4-8-16(3)11-6-5-10(13(11)15)14(16)12(17)9-21(18,19)20/h10-11,13-14,18-21H,4-9H2,1-3H3/t10-,11+,13-,14+,16-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+4n/an/an/an/an/an/a



University of Helsinki

Curated by ChEMBL


Assay Description
Inhibition of human UGT2B7 assessed as reduction of estriol glucuronidation


J Med Chem 50: 2655-64 (2007)


Article DOI: 10.1021/jm061204e
BindingDB Entry DOI: 10.7270/Q23F4QF2
More data for this
Ligand-Target Pair