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Compile Data Set for Download or QSAR

Found 138 hits Enz. Inhib. hit(s) with all data for entry = 8836   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422059
PNG
(US10508103, Embodiment 1)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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US Patent
n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422074
PNG
(US10508103, Embodiment 27)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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US Patent
n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422062
PNG
(US10508103, Embodiment 14)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422063
PNG
(US10508103, Embodiment 16)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422064
PNG
(US10508103, Embodiment 17)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CCC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422064
PNG
(US10508103, Embodiment 17)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CCC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422065
PNG
(US10508103, Embodiment 18)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422066
PNG
(US10508103, Embodiment 19)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422067
PNG
(US10508103, Embodiment 20)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422068
PNG
(US10508103, Embodiment 21)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422069
PNG
(US10508103, Embodiment 22)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422070
PNG
(US10508103, Embodiment 23)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422070
PNG
(US10508103, Embodiment 23)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422071
PNG
(US10508103, Embodiment 24)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422072
PNG
(US10508103, Embodiment 25)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422073
PNG
(US10508103, Embodiment 26)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422073
PNG
(US10508103, Embodiment 26)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422073
PNG
(US10508103, Embodiment 26)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422074
PNG
(US10508103, Embodiment 27)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422074
PNG
(US10508103, Embodiment 27)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422075
PNG
(US10508103, Embodiment 28)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422075
PNG
(US10508103, Embodiment 28)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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US Patent
n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422076
PNG
(US10508103, Embodiment 29)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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US Patent
n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422077
PNG
(US10508103, Embodiment 30)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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US Patent
n/an/a<10n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422078
PNG
(US10508103, Embodiment 31)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422079
PNG
(US10508103, Embodiment 32)
Show SMILES CCC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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US Patent
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422080
PNG
(US10508103, Embodiment 36)
Show SMILES CCC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1 |r|
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US Patent
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422081
PNG
(US10508103, Embodiment 38)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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US Patent
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422081
PNG
(US10508103, Embodiment 38)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422082
PNG
(US10508103, Embodiment 39)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422082
PNG
(US10508103, Embodiment 39)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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US Patent
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422083
PNG
(US10508103, Embodiment 40)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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US Patent
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422084
PNG
(US10508103, Embodiment 42)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422084
PNG
(US10508103, Embodiment 42)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cn1c(nc2cc(F)ccc12)-c1[nH]c2cc(F)ccc2c1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422086
PNG
(US10508103, Embodiment 44)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1CC(F)(F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CC(F)(F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422086
PNG
(US10508103, Embodiment 44)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1CC(F)(F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CC(F)(F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422087
PNG
(US10508103, Embodiment 46)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CC(F)(F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CC(F)(F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422060
PNG
(US10508103, Embodiment 2)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422059
PNG
(US10508103, Embodiment 1)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422059
PNG
(US10508103, Embodiment 1)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422060
PNG
(US10508103, Embodiment 2)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1CCC[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 2 [253-363]


(Homo sapiens (Human))
BDBM422061
PNG
(US10508103, Embodiment 13)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@H](CC)NC(=O)[C@H](C)NC |r|
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MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422061
PNG
(US10508103, Embodiment 13)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@H](CC)NC(=O)[C@H](C)NC |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422061
PNG
(US10508103, Embodiment 13)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@H](CC)NC(=O)[C@H](C)NC |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422062
PNG
(US10508103, Embodiment 14)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422062
PNG
(US10508103, Embodiment 14)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CC1 |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422063
PNG
(US10508103, Embodiment 16)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP [241-356]


(Homo sapiens (Human))
BDBM422063
PNG
(US10508103, Embodiment 16)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422064
PNG
(US10508103, Embodiment 17)
Show SMILES CN[C@@H](C)C(=O)N[C@@H](C1CCC1)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCC1 |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 3 [238-349]


(Homo sapiens (Human))
BDBM422065
PNG
(US10508103, Embodiment 18)
Show SMILES CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](F)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1nc2cc(F)ccc2n1C[C@@H]1C[C@H](F)CN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C(C)C |r|
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/an/a



MEDSHINE DISCOVERY INC.

US Patent


Assay Description
1) Affinity of compounds listed in table to cIAP1-BIR3, Ciap2-BIR3, XIAP-BIR3 was tested referring to Nikolovska-Colesks, Z. et.Al. (Analytical Bioch...


US Patent US10508103 (2019)


BindingDB Entry DOI: 10.7270/Q25141MH
More data for this
Ligand-Target Pair
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