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Patent code US9556117

Compile Data Set for Download or QSAR
Found 95 hits of Enzyme Inhibition Constant Data   
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
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274361
PNG
(US95556117, Example 25,4-Chloro-7-methyl-1H-indole...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 2.90n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274412
PNG
(US95556117, Example 76,4-Chloro-7-methoxy-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 2.90n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274348
PNG
(US95556117, Example 12,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1ccc(cn1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 3.20n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274419
PNG
(US95556117, Example 83,4-Chloro-7-propyl-1H-indole...)
Show SMILES CCCc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 3.30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274418
PNG
(US95556117, Example 82,4-Chloro-7-propyl-1H-indole...)
Show SMILES CCCc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 3.80n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274397
PNG
(US95556117, Example 61,4-Chloro-7-methyl-1H-indole...)
Show SMILES Cc1ncc(cn1)C1(CNC(=O)c2cc(C)c3[nH]ccc3c2Cl)CCC(F)(F)CC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274399
PNG
(US95556117, Example 63,4,7-Dimethyl-1H-indole-5-ca...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(C)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274398
PNG
(US95556117, Example 62,4-Chloro-7-methyl-1H-indole...)
Show SMILES Cc1ncc(cn1)C1(CNC(=O)c2cc(C)c3[nH]ccc3c2Cl)CCCCC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274408
PNG
(US95556117, Example 72,4-Chloro-7-ethyl-1H-indole-...)
Show SMILES CCc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274347
PNG
(US95556117, Example 11,4-Chloro-1H-indole-5-carbox...)
Show SMILES FC(F)(F)c1ncc(cn1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274409
PNG
(US95556117, Example 73,4-Chloro-7-ethyl-1H-indole-...)
Show SMILES CCc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.20n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274389
PNG
(US95556117, Example 53,4-Chloro-7-(3-methoxy-propy...)
Show SMILES COCCCc1cc(C(=O)NCC2(O)CCCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.40n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274350
PNG
(US95556117, Example 14,4-Chloro-1H-indole-5-carbox...)
Show SMILES FC1(F)CCC(CNC(=O)c2ccc3[nH]ccc3c2Cl)(CC1)c1ccc(Cl)nc1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.5n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274360
PNG
(US95556117, Example 24,4-Chloro-7-methyl-1H-indole...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.70n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274403
PNG
(US95556117, Example 67,rac-4-Chloro-7-(1-hydroxy-e...)
Show SMILES CC(O)c1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 4.70n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274395
PNG
(US95556117, Example 59,4-Chloro-7-methoxy-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 5.40n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274417
PNG
(US95556117, Example 81,4-Chloro-7-ethoxy-1H-indole...)
Show SMILES CCOc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 5.40n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274388
PNG
(US95556117, Example 52,4-Chloro-7-isobutyl-1H-indo...)
Show SMILES CC(C)Cc1cc(C(=O)NCC2(O)CCCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 5.90n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274415
PNG
(US95556117, Example 79,4-Chloro-7-ethoxy-1H-indole...)
Show SMILES CCOc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274356
PNG
(US95556117, Example 20,4-Chloro-7-methyl-1H-indole...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274396
PNG
(US95556117, Example 60,4-Chloro-1H-indole-5-carbox...)
Show SMILES Cc1ncc(cn1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCC(F)(F)CC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274394
PNG
(US95556117, Example 58,4-Chloro-1H-indole-5-carbox...)
Show SMILES Cc1ncc(cn1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.40n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274422
PNG
(US95556117, Example 86,4-Chloro-7-(2-hydroxy-ethox...)
Show SMILES OCCOc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.70n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274391
PNG
(US95556117, Example 55,4-Chloro-7-(3-methoxy-propy...)
Show SMILES COCCCc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 6.70n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274404
PNG
(US95556117, Example 68,4-Chloro-7-(1-hydroxy-1-met...)
Show SMILES CC(C)(O)c1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 7.20n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274423
PNG
(US95556117, Example 87,4-Chloro-7-(2-hydroxy-ethox...)
Show SMILES OCCOc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 7.30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274425
PNG
(US95556117, Example 89,4-Chloro-7-(1-hydroxy-1-met...)
Show SMILES CC(C)(O)c1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 8.30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274392
PNG
(US95556117, Example 56,4-Chloro-1H-indole-5-carbox...)
Show SMILES OCCS(=O)(=O)NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 9n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274431
PNG
(US95556117, Example 95,4-Chloro-7-(1-methoxy-1-met...)
Show SMILES COC(C)(C)c1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 9.30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274430
PNG
(US95556117, Example 94,4-Chloro-7-(2-ethoxy-ethyl)...)
Show SMILES CCOCCc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 9.40n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274411
PNG
(US95556117, Example 75,7-Chloro-4-methyl-1H-indole...)
Show SMILES Cc1c(cc(Cl)c2[nH]ccc12)C(=O)NCC1(O)CCC(F)(F)CC1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 9.5n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274405
PNG
(US95556117, Example 69,7-Methyl-4-trifluoromethyl-...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCCCC2)c(c2cc[nH]c12)C(F)(F)F
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
UniChem
n/an/a 10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274406
PNG
(US95556117, Example 70,7-Methyl-4-trifluoromethyl-...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(c2cc[nH]c12)C(F)(F)F
PDB

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n/an/a 10n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274368
PNG
(US95556117, Example 32,7-Amino-4-chloro-1H-indole-...)
Show SMILES Nc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 11n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274362
PNG
(US95556117, Example 26,4-Chloro-3-fluoro-1H-indole...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]cc(F)c3c2Cl)CCCCCC1
PDB

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n/an/a 11.4n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274339
PNG
(US95556117, Example 3,4-Chloro-1H-indole-5-carboxy...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCCC1
PDB

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n/an/a 12n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274407
PNG
(US95556117, Example 71,4,7-Dimethyl-1H-indole-5-ca...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCCCC2)c(C)c2cc[nH]c12
PDB

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n/an/a 12n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274390
PNG
(US95556117, Example 54,4-Chloro-7-isobutyl-1H-indo...)
Show SMILES CC(C)Cc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 13n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274337
PNG
(US95556117, Example 1,4-Chloro-1H-indole-5-carboxy...)
Show SMILES OC[C@@H](NC(=O)c1ccc2[nH]ccc2c1Cl)C1CCCCC1
PDB

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n/an/a 13n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274378
PNG
(US95556117, Example 42,4-Chloro-1H-indole-5-carbox...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCCCC1
PDB

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n/an/a 14n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274353
PNG
(US95556117, Example 17,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1c(ccc2[nH]ccc12)C(=O)NCC1(CCCCC1)c1cccnc1
PDB

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n/an/a 14n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274349
PNG
(US95556117, Example 13,4-Chloro-1H-indole-5-carbox...)
Show SMILES FC(F)(F)c1ccc(cn1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 17n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274410
PNG
(US95556117, Example 74,7-Chloro-4-methyl-1H-indole...)
Show SMILES Cc1c(cc(Cl)c2[nH]ccc12)C(=O)NCC1(O)CCCCC1
PDB

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n/an/a 17n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274355
PNG
(US95556117, Example 19,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1c(ccc2[nH]ccc12)C(=O)NCC1(CCCCCC1)c1cccnc1
PDB

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n/an/a 18n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274365
PNG
(US95556117, Example 29,4-Chloro-7-nitro-1H-indole-...)
Show SMILES OC1(CNC(=O)c2cc([N+]([O-])=O)c3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 20n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274413
PNG
(US95556117, Example 77,7-Methoxy-4-methyl-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(C)c2cc[nH]c12
PDB

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n/an/a 21n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274414
PNG
(US95556117, Example 78,7-Methoxy-4-methyl-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCCCC2)c(C)c2cc[nH]c12
PDB

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n/an/a 21n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274383
PNG
(US95556117, Example 47,4-Chloro-1H-indole-5-carbox...)
Show SMILES CS(=O)(=O)NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 21n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274387
PNG
(US95556117, Example 51,(1-{[(4-Chloro-1H-indole-5-...)
Show SMILES COC(=O)CS(=O)(=O)NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 24n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274402
PNG
(US95556117, Example 66,7-Acetyl-4-chloro-1H-indole...)
Show SMILES CC(=O)c1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 24n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274424
PNG
(US95556117, Example 88,7-Acetyl-4-chloro-1H-indole...)
Show SMILES CC(=O)c1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 25n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274420
PNG
(US95556117, Example 84,7-(2-tert-Butoxy-ethoxy)-4-...)
Show SMILES CC(C)(C)OCCOc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 25n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274372
PNG
(US95556117, Example 36,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1c(ccc2[nH]ccc12)C(=O)NCC1(CCCCC1)C#N
PDB

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n/an/a 27n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274421
PNG
(US95556117, Example 85,7-(2-tert-Butoxy-ethoxy)-4-...)
Show SMILES CC(C)(C)OCCOc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 30n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274338
PNG
(US95556117, Example 2,4-Chloro-1H-indole-5-carboxy...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 35n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274367
PNG
(US95556117, Example 31,4-Chloro-1H-indole-5-carbox...)
Show SMILES OCC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 38n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274340
PNG
(US95556117, Example 4,4-Chloro-1H-indole-5-carboxy...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCC(F)(F)CC1
PDB

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n/an/a 42n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274369
PNG
(US95556117, Example 33,4-Chloro-3-methyl-1H-indole...)
Show SMILES Cc1c[nH]c2ccc(C(=O)NCC3(O)CCCCCC3)c(Cl)c12
PDB

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n/an/a 44n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274428
PNG
(US95556117, Example 92,4-Fluoro-7-methoxy-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCCCC2)c(F)c2cc[nH]c12
PDB

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n/an/a 45n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274343
PNG
(US95556117, Example 7,4-Chloro-1-methyl-1H-indole-...)
Show SMILES Cn1ccc2c(Cl)c(ccc12)C(=O)N[C@H](CO)C1CCCCC1
Show InChI InChI=1S/C18H23ClN2O2/c1-21-10-9-13-16(21)8-7-14(17(13)19)18(23)20-15(11-22)12-5-3-2-4-6-12/h7-10,12,15,22H,2-6,11H2,1H3,(H,20,23)/t15-/m1/s1
PDB

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ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274400
PNG
(US95556117, Example 64,4-Methyl-1H-indole-5-carbox...)
Show SMILES Cc1c(ccc2[nH]ccc12)C(=O)NCC1(O)CCC(F)(F)CC1
PDB

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n/an/a 51n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274346
PNG
(US95556117, Example 10,rac-4-Chloro-1H-indole-5-ca...)
Show SMILES OCC(NC(=O)c1ccc2[nH]ccc2c1Cl)C1CCCCCC1
PDB

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n/an/a 57n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274393
PNG
(US95556117, Example 57,4-Methyl-1H-indole-5-carbox...)
Show SMILES Cc1c(ccc2[nH]ccc12)C(=O)NCC1(O)CCCCC1
PDB

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n/an/a 68n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274429
PNG
(US95556117, Example 93,4-Fluoro-7-methoxy-1H-indol...)
Show SMILES COc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(F)c2cc[nH]c12
PDB

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n/an/a 70n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274341
PNG
(US95556117, Example 5,4-Chloro-1H-indole-5-carboxy...)
Show SMILES OC[C@@H](NC(=O)c1ccc2[nH]ccc2c1Cl)C1CCC(F)(F)CC1
PDB

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n/an/a 77n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274401
PNG
(US95556117, Example 65,4-Ethyl-1H-indole-5-carboxy...)
Show SMILES CCc1c(ccc2[nH]ccc12)C(=O)NCC1(O)CCC(F)(F)CC1
PDB

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n/an/a 79n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274381
PNG
(US95556117, Example 45,4-Chloro-1H-indole-5-carbox...)
Show SMILES C[C@@H](NC(=O)c1ccc2[nH]ccc2c1Cl)C1CCCCC1
PDB

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n/an/a 81n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274416
PNG
(US95556117, Example 80,4-Chloro-7-hydroxy-1H-indol...)
Show SMILES Oc1cc(C(=O)NCC2(O)CCC(F)(F)CC2)c(Cl)c2cc[nH]c12
PDB

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n/an/a 100n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274370
PNG
(US95556117, Example 34,4-Chloro-1H-indole-5-carbox...)
Show SMILES NC(=O)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 130n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274364
PNG
(US95556117, Example 28,3,4-Dichloro-1H-indole-5-ca...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]cc(Cl)c3c2Cl)CCCCC1
PDB

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n/an/a 151n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274354
PNG
(US95556117, Example 18,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1c(ccc2[nH]ccc12)C(=O)NCC1(CCCC1)c1cccnc1
PDB

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n/an/a 178n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274344
PNG
(US95556117, Example 8,4-Chloro-3-formyl-1H-indole-...)
Show SMILES OC[C@@H](NC(=O)c1ccc2[nH]cc(C=O)c2c1Cl)C1CCCCC1
PDB

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n/an/a 198n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274382
PNG
(US95556117, Example 46,4-Chloro-1H-indole-5-carbox...)
Show SMILES CC(=O)NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 209n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274342
PNG
(US95556117, Example 6,4-Chloro-1-methyl-1H-indole-...)
Show SMILES Cn1ccc2c(Cl)c(ccc12)C(=O)NCC1(O)CCCCC1
Show InChI InChI=1S/C17H21ClN2O2/c1-20-10-7-12-14(20)6-5-13(15(12)18)16(21)19-11-17(22)8-3-2-4-9-17/h5-7,10,22H,2-4,8-9,11H2,1H3,(H,19,21)
PDB

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n/an/a 211n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274379
PNG
(US95556117, Example 43,4-Chloro-1H-indole-5-carbox...)
Show SMILES COC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 218n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274366
PNG
(US95556117, Example 30,1-{[(4-Chloro-1H-indole-5-c...)
Show SMILES COC(=O)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 221n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274351
PNG
(US95556117, Example 15,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1ccc(cc1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 238n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274386
PNG
(US95556117, Example 50,3-Bromo-4-chloro-7-methyl-1...)
Show SMILES Cc1cc(C(=O)NCC2(O)CCCCC2)c(Cl)c2c(Br)c[nH]c12
PDB

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n/an/a 246n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274377
PNG
(US95556117, Example 41,4-Chloro-1H-indole-5-carbox...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCC1
PDB

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n/an/a 264n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274357
PNG
(US95556117, Example 21,4-Chloro-2-oxo-2,3-dihydro-...)
Show SMILES OC1(CNC(=O)c2ccc3NC(=O)Cc3c2Cl)CCCCCC1
Show InChI InChI=1S/C17H21ClN2O3/c18-15-11(5-6-13-12(15)9-14(21)20-13)16(22)19-10-17(23)7-3-1-2-4-8-17/h5-6,23H,1-4,7-10H2,(H,19,22)(H,20,21)
PDB

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n/an/a 302n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274373
PNG
(US95556117, Example 37,(1-{[(4-Chloro-1H-indole-5-...)
Show SMILES CC(C)(C)OC(=O)NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 420n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274352
PNG
(US95556117, Example 16,4-Chloro-1H-indole-5-carbox...)
Show SMILES FC(F)(F)c1ccc(cc1)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 442n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274385
PNG
(US95556117, Example 49,4-Chloro-1H-indole-5-carbox...)
Show SMILES Clc1c(ccc2[nH]ccc12)C(=O)NCC1(CCCCC1)NCc1ccccc1
PDB

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n/an/a 497n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274426
PNG
(US95556117, Example 90,4,7-Difluoro-1H-indole-5-ca...)
Show SMILES OC1(CNC(=O)c2cc(F)c3[nH]ccc3c2F)CCCCC1
PDB

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n/an/a 563n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274371
PNG
(US95556117, Example 35,4-Chloro-1H-indole-5-carbox...)
Show SMILES CNC(=O)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 666n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274363
PNG
(US95556117, Example 27,4-Methoxy-1H-indole-5-carbo...)
Show SMILES COc1c(ccc2[nH]ccc12)C(=O)NCC1(O)CCCCCC1
PDB

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n/an/a 682n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274427
PNG
(US95556117, Example 91,4,7-Difluoro-1H-indole-5-ca...)
Show SMILES OC1(CNC(=O)c2cc(F)c3[nH]ccc3c2F)CCC(F)(F)CC1
PDB

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n/an/a 701n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274384
PNG
(US95556117, Example 48,4-Chloro-1H-indole-5-carbox...)
Show SMILES CN(C)C1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 1.08E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274359
PNG
(US95556117, Example 23,4-Chloro-7-iodo-3-methylsul...)
Show SMILES CSc1c[nH]c2c(I)cc(C(=O)NCC3(O)CCCCC3)c(Cl)c12
PDB

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n/an/a 1.15E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274345
PNG
(US95556117, Example 9,4-Chloro-3-formyl-1H-indole-...)
Show SMILES OC1(CNC(=O)c2ccc3[nH]cc(C=O)c3c2Cl)CCCCC1
PDB

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n/an/a 1.15E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274358
PNG
(US95556117, Example 22,4-Chloro-2-methyl-1H-indole...)
Show SMILES Cc1cc2c(Cl)c(ccc2[nH]1)C(=O)NCC1(O)CCCCC1
PDB

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n/an/a 1.18E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274374
PNG
(US95556117, Example 38,4,6-Dichloro-1H-indole-5-ca...)
Show SMILES OC1(CNC(=O)c2c(Cl)cc3[nH]ccc3c2Cl)CCC(F)(F)CC1
PDB

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n/an/a 1.32E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274380
PNG
(US95556117, Example 44,4-Chloro-1H-indole-5-carbox...)
Show SMILES C[C@H](NC(=O)c1ccc2[nH]ccc2c1Cl)C1CCCCC1
PDB

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n/an/a 1.43E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274375
PNG
(US95556117, Example 39,4-Chloro-1H-indole-5-carbox...)
Show SMILES NC1(CNC(=O)c2ccc3[nH]ccc3c2Cl)CCCCC1
PDB

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n/an/a 1.56E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
P2X purinoceptor 7


(Homo sapiens (Human))
BDBM274376
PNG
(US95556117, Example 40,4-Chloro-6-methyl-1H-indole...)
Show SMILES Cc1cc2[nH]ccc2c(Cl)c1C(=O)NCC1(O)CCCCC1
PDB

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n/an/a 1.60E+3n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD.

US Patent


Assay Description
The amplified sequence was subsequently ligated into a pcDNA3.1 (+) NotI, NheI digested plasmid. Human embryonic kidney (HEK) cells (ATCC CRL-1573, M...


US Patent US9556117 (2017)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%