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BDBM520 1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[(2S)-3-methyl-2-{[methyl({[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl})carbamoyl]amino}butanamido]-1,6-diphenylhexan-2-yl]carbamate::ABT-538::CHEMBL163::Norvir::RTV::Ritonavir

SMILES: CC(C)[C@H](NC(=O)N(C)Cc1csc(n1)C(C)C)C(=O)N[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1cncs1)Cc1ccccc1

InChI Key: InChIKey=NCDNCNXCDXHOMX-UHFFFAOYSA-N

Data: 52 KI  31 IC50  2 Kd  1 Koff  1 Kon  18 ITC

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 85 hits for monomerid = 520   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
ATP-dependent translocase ABCB1


(Mouse)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a>5.00E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Broad substrate specificity ATP-binding cassette transporter ABCG2


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.95E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier organic anion transporter family member 1B1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.30E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier organic anion transporter family member 1B3


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 4.40E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier organic anion transporter family member 2B1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 6.10E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.57E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 100n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 3.96E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/an/a 0.600n/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.20E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 1A2


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a>2.50E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.50E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.20E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Mouse)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a>5.00E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 250n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 30n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 2B6


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 2.00E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/an/an/an/a 0.00216n/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Multidrug and toxin extrusion protein 2


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 2.37E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 2C19


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 1.27E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 2C9


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 4.90E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 2D6


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 2.30E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cytochrome P450 3A4


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 550n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Multidrug and toxin extrusion protein 1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 80n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Multidrug and toxin extrusion protein 1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 2.10E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier family 22 member 2


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 2.48E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier family 22 member 1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 3.39E+4n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
ATP-dependent translocase ABCB1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 3.80E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 67n/an/an/an/a4.530


TBA



Citation and Details
More data for this
Ligand-Target Pair
Multidrug and toxin extrusion protein 1


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 4.40E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Multidrug and toxin extrusion protein 2


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a 4.40E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Solute carrier family 22 member 3


(Human)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
n/an/a>3.00E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0150n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0150n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0200n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [501-599,Q508K,L534I,L564I,C568A,C596A]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0200 -14.6n/an/an/an/an/a6.425


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [489-587,Q496K]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0270 -14.4n/an/an/an/an/a5.025


TBA



Citation and Details
More data for this
Ligand-Target Pair
HIV-1 protease


(Human immunodeficiency virus)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0600n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.0620n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.120n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [501-599,M537I]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.150 -13.9n/an/an/an/an/a4.737


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [482-580,I502K,I528M,T553A]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.200 -13.8n/an/an/an/an/a4.737


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [501-599,Q508K,L534I,L564I,C568A,C596A,D531N]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.230 -13.7n/an/an/an/an/a4.737


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.370n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.370n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.370n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.370n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
HIV-1 protease


(Human immunodeficiency virus)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.370n/an/an/an/an/an/a5.5n/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Dimer of Gag-Pol polyprotein [491-589,Q498K,D521N,V555I,N579D]


(Human immunodeficiency virus type 1)
BDBM520
PNG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
UniChem
0.460n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 85 total )  |  Next  |  Last  >>

Activity Spreadsheet -- ITC Data from BindingDB

Found 18 hits for monomerid = 520
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
HIV-1 Protease

(Human immunodeficiency virus type 1)
GoogleScholar
-13.5-11.2-2.30n/a525


TBA



Details of this binding reaction

BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
HIV-1 Protease Mutant (V82F/I84V)

(Human immunodeficiency virus type 1)
GoogleScholar
-9.98-10.50.499n/a525


TBA



Details of this binding reaction

HIV-1 Protease

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-13.7-9.39-4.2910525


TBA



Details of this binding reaction

HIV-1 Protease Mutant, MDR-HM

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-9.28-12.22.906.83525


TBA



Details of this binding reaction

HIV-1 Protease Mutant, MDR-QM

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-10.7-14.03.297.87525


TBA



Details of this binding reaction

HIV-1 Protease Mutant (V82A/I84V)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-11.9-8.29-3.598.70525


TBA



Details of this binding reaction

HIV-1 Protease Mutant (M46I/I54V)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-12.8-13.70.8999.36525


TBA



Details of this binding reaction

HIV-1 Protease Mutant (L10I/L90M)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-12.9-10.1-2.809.43525


TBA



Details of this binding reaction

HIV-1 Protease B Subtype

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-14.4-10.7-3.6910.5525


TBA



Details of this binding reaction

HIV-1 Protease C Subtype

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-13.4-10.3-3.099.80525


TBA



Details of this binding reaction

HIV-1 Protease A Subtype

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-13.2-10.3-2.909.65525


TBA



Details of this binding reaction

HIV-1 Protease B Subtype Mutant (V82F/I84V)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-10.9-10.2-0.6997.95525


TBA



Details of this binding reaction

HIV-1 Protease C Subtype Mutant (V82F/I84V)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-9.78-8.69-1.107.21525


TBA



Details of this binding reaction

HIV-1 Protease A Subtype Mutant (V82F/I84V)

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-9.68-8.49-1.207.08525


TBA



Details of this binding reaction

HIV-1 Protease Mutant, ANAM-11

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-7.69-1.40-6.295.64525


TBA



Details of this binding reaction

HIV-1 Protease Mutant, A-1

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-12.0-12.00.02008.80525


TBA



Details of this binding reaction

HIV-1 Protease Mutant, NAM-10

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-8.79-6.49-2.306.43525


TBA



Details of this binding reaction

HIV-1 Protease

(Human immunodeficiency virus type 1)
BDBM520
JPEG
(ABT-538 | Norvir | CHEMBL163 | 1,3-thiazol-5-ylmet...)
GoogleScholar
-14.4-10.7-3.6910.5525


TBA



Details of this binding reaction