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Compile Data Set for Download or QSAR

Found 2592 hits Enz. Inhib. hit(s) with Target = 'Coagulation factor XI'   
Target
(Institution)
LigandTarget
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
Coagulation factor XI


(Homo sapiens (human))
BDBM246227
PNG
(US9434690, 132 | US9434690, 133 | US9434690, 134 |...)
PDB
MMDB

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n/an/a 0.300n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246196
PNG
(US9434690, 101 | US9434690, 102 | US9434690, 103 |...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246220
PNG
(US9434690, 125 | US9434690, 141 | US9434690, 142 |...)
PDB
MMDB

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n/an/a 0.600n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246174
PNG
(US9434690, 79 | US9434690, 80 | US9434690, 81)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246249
PNG
(US9434690, 155 | US9434690, 156 | US9434690, 157)
PDB
MMDB

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n/an/a 0.800n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246231
PNG
(US9434690, 136 | US9434690, 137 | US9434690, 138)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM238267
PNG
(US9394250, 99)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)[C@@H]1C[C@@H](CN1C(=O)C1CCC(CC1)C(N)=N)N1CCN(CC1)S(C)(=O)=O
PDB
MMDB

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n/an/a 1.20n/an/an/an/an/an/a



ONO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9394250 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246182
PNG
(US9434690, 87 | US9434690, 88 | US9434690, 89)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246196
PNG
(US9434690, 101 | US9434690, 102 | US9434690, 103 |...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246293
PNG
(US9434690, 199)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246171
PNG
(US9434690, 76 | US9434690, 77 | US9434690, 78)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246196
PNG
(US9434690, 101 | US9434690, 102 | US9434690, 103 |...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246192
PNG
(US9434690, 100 | US9434690, 97 | US9434690, 98 | U...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246154
PNG
(US9434690, 59 | US9434690, 60)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246171
PNG
(US9434690, 76 | US9434690, 77 | US9434690, 78)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246231
PNG
(US9434690, 136 | US9434690, 137 | US9434690, 138)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246161
PNG
(US9434690, 140 | US9434690, 66 | US9434690, 67 | U...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246212
PNG
(US9434690, 117)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246150
PNG
(US9434690, 55 | US9434690, 56 | US9434690, 57)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246249
PNG
(US9434690, 155 | US9434690, 156 | US9434690, 157)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246227
PNG
(US9434690, 132 | US9434690, 133 | US9434690, 134 |...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM238259
PNG
(US9394250, 71)
Show SMILES COC(=O)Nc1ccc(cc1)-c1[nH]c(nc1Cl)[C@@H]1C[C@@H](CN1C(=O)C1CCN(CC1)C(N)=N)C1CCN(CC1)S(C)(=O)=O
PDB
MMDB

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US Patent
n/an/a 2.20n/an/an/an/an/an/a



ONO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9394250 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246258
PNG
(US9434690, 164)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246272
PNG
(US9434690, 178 | US9434690, 179)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246211
PNG
(US9434690, 116)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246201
PNG
(US9434690, 106)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM238268
PNG
(US9394250, 98)
Show SMILES COC(=O)Nc1ccc(cc1)-c1cnc([nH]1)[C@@H]1C[C@@H](CN1C(=O)C1CCN(CC1)C(N)=N)N1CCN(CC1)S(C)(=O)=O
PDB
MMDB

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n/an/a 2.30n/an/an/an/an/an/a



ONO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9394250 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246179
PNG
(US9434690, 84 | US9434690, 85 | US9434690, 86)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246189
PNG
(US9434690, 94 | US9434690, 95 | US9434690, 96)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246246
PNG
(US9434690, 152 | US9434690, 153 | US9434690, 154)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246234
PNG
(US9434690, 139)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246267
PNG
(US9434690, 173)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246287
PNG
(US9434690, 193)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246227
PNG
(US9434690, 132 | US9434690, 133 | US9434690, 134 |...)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246280
PNG
(US9434690, 186 | US9434690, 187)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246182
PNG
(US9434690, 87 | US9434690, 88 | US9434690, 89)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM50120368
PNG
((2S,3R)-1-(4-tert-Butylcarbamoyl-piperazine-1-carb...)
Show SMILES CC(C)(C)NC(=O)N1CCN(CC1)C(=O)N1[C@@H]([C@@H](CCCNC(N)=N)C1=O)C(O)=O
Show InChI InChI=1S/C18H31N7O5/c1-18(2,3)22-16(29)23-7-9-24(10-8-23)17(30)25-12(14(27)28)11(13(25)26)5-4-6-21-15(19)20/h11-12H,4-10H2,1-3H3,(H,22,29)(H,27,28)(H4,19,20,21)/t11-,12+/m1/s1
PDB
MMDB

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Patents


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PubMed
n/an/a 2.80n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Irreversible inhibition of human factor 11a


Citation and Details
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246296
PNG
(US9434690, 202)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246286
PNG
(US9434690, 192)
PDB
MMDB

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Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246272
PNG
(US9434690, 178 | US9434690, 179)
PDB
MMDB

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n/an/a 3n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246208
PNG
(US9434690, 113 | US9434690, 114 | US9434690, 115)
PDB
MMDB

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n/an/a 3n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM238252
PNG
(US9394250, 20)
Show SMILES CS(=O)(=O)N1CCN(CC1)[C@H]1C[C@H](N(C1)C(=O)c1ccc(cc1)C(N)=N)C(=O)Nc1ccc(cc1)C(O)=O
PDB
MMDB

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US Patent
n/an/a 3.20n/an/an/an/an/an/a



ONO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
Human Factor XIa (Haematologic Technologies Inc.) activity was measured at an enzyme concentration of 0.1 U/mL in 150 mM NaCl, 5 mM KCl, 1 mg/mL PEG6...


US Patent US9394250 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246174
PNG
(US9434690, 79 | US9434690, 80 | US9434690, 81)
PDB
MMDB

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n/an/a 3.20n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246185
PNG
(US9434690, 90 | US9434690, 91 | US9434690, 92 | US...)
PDB
MMDB

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n/an/a 3.20n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246271
PNG
(US9434690, 177)
PDB
MMDB

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n/an/a 3.40n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246164
PNG
(US9434690, 69)
PDB
MMDB

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n/an/a 3.5n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246220
PNG
(US9434690, 125 | US9434690, 141 | US9434690, 142 |...)
PDB
MMDB

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n/an/a 3.60n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246161
PNG
(US9434690, 140 | US9434690, 66 | US9434690, 67 | U...)
PDB
MMDB

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n/an/a 3.80n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246220
PNG
(US9434690, 125 | US9434690, 141 | US9434690, 142 |...)
PDB
MMDB

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n/an/a 3.90n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (human))
BDBM246262
PNG
(US9434690, 168)
PDB
MMDB

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n/an/a 3.90n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent




US Patent US9434690 (2016)

More data for this
Ligand-Target Pair
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