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Patent code US10137202

Compile Data Set for Download or QSAR
Found 11 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
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303132
PNG
(US10137202, Compound TAM552)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCOCCOCCNC(=O)CCCCCN1C(=O)C=CC1=O)Cc1ccc(O)cc1
Show InChI InChI=1S/C60H95N9O14S/c1-9-26-68(59(77)54(42(6)11-3)64-57(76)48-17-14-16-27-67(48)8)49(41(4)5)39-50(82-29-10-2)58-63-47(40-84-58)56(75)62-45(38-44-19-21-46(70)22-20-44)37-43(7)55(74)65-66-60(78)83-36-35-81-34-33-80-32-31-79-30-25-61-51(71)18-13-12-15-28-69-52(72)23-24-53(69)73/h19-24,40-43,45,48-50,54,70H,9-18,25-39H2,1-8H3,(H,61,71)(H,62,75)(H,64,76)(H,65,74)(H,66,78)/t42-,43-,45+,48+,49+,50+,54-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 10n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303131
PNG
(US10137202, Compound TAM471)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCc1ccc(NC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccc(O)cc1
Show InChI InChI=1S/C70H105N13O14S/c1-11-34-82(68(93)61(45(8)13-3)78-65(91)54-21-16-18-35-81(54)10)55(43(4)5)40-56(96-37-12-2)67-76-53(42-98-67)64(90)74-50(39-47-25-29-51(84)30-26-47)38-46(9)62(88)79-80-70(95)97-41-48-23-27-49(28-24-48)73-63(89)52(20-19-33-72-69(71)94)75-66(92)60(44(6)7)77-57(85)22-15-14-17-36-83-58(86)31-32-59(83)87/h23-32,42-46,50,52,54-56,60-61,84H,11-22,33-41H2,1-10H3,(H,73,89)(H,74,90)(H,75,92)(H,77,85)(H,78,91)(H,79,88)(H,80,95)(H3,71,72,94)/t45-,46-,50+,52+,54+,55+,56+,60+,61-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 29.5n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303130
PNG
(US10137202, Compound TAM551)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)C([C@@H](C)CC)N(C)C(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(O)=O)Cc1ccccc1
Show InChI InChI=1S/C70H105N11O14S/c1-13-35-80(54(43(5)6)40-55(94-37-14-2)66-76-53(42-96-66)63(86)74-51(38-47(11)68(90)91)39-48-24-19-17-20-25-48)67(89)60(45(9)15-3)78-65(88)61(46(10)16-4)79(12)70(93)95-41-49-28-30-50(31-29-49)73-62(85)52(26-23-34-72-69(71)92)75-64(87)59(44(7)8)77-56(82)27-21-18-22-36-81-57(83)32-33-58(81)84/h17,19-20,24-25,28-33,42-47,51-52,54-55,59-61H,13-16,18,21-23,26-27,34-41H2,1-12H3,(H,73,85)(H,74,86)(H,75,87)(H,77,82)(H,78,88)(H,90,91)(H3,71,72,92)/t45-,46-,47-,51+,52-,54+,55+,59-,60-,61?/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC sid
UniChem
US Patent
n/an/a 90n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303138
PNG
(US10137202, Compound TAM553)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCNC(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccccc1
Show InChI InChI=1S/C75H114N14O16S/c1-11-36-88(72(98)65(50(8)13-3)84-69(96)58-26-19-21-37-87(58)10)59(48(4)5)45-60(103-39-12-2)71-82-57(47-106-71)68(95)80-55(44-52-23-16-14-17-24-52)43-51(9)66(93)85-86-75(101)104-42-41-102-40-35-78-74(100)105-46-53-28-30-54(31-29-53)79-67(94)56(25-22-34-77-73(76)99)81-70(97)64(49(6)7)83-61(90)27-18-15-20-38-89-62(91)32-33-63(89)92/h14,16-17,23-24,28-33,47-51,55-56,58-60,64-65H,11-13,15,18-22,25-27,34-46H2,1-10H3,(H,78,100)(H,79,94)(H,80,95)(H,81,97)(H,83,90)(H,84,96)(H,85,93)(H,86,101)(H3,76,77,99)/t50-,51-,55+,56-,58+,59+,60+,64-,65-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 98n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303139
PNG
(US10137202, Compound TAM558)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCOCCOCCNC(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccc(O)cc1
Show InChI InChI=1S/C79H122N14O19S/c1-11-35-92(76(103)69(53(8)13-3)88-73(101)62-21-16-18-36-91(62)10)63(51(4)5)48-64(110-38-12-2)75-86-61(50-113-75)72(100)84-58(47-55-25-29-59(94)30-26-55)46-54(9)70(98)89-90-79(106)111-45-44-109-43-42-108-41-40-107-39-34-82-78(105)112-49-56-23-27-57(28-24-56)83-71(99)60(20-19-33-81-77(80)104)85-74(102)68(52(6)7)87-65(95)22-15-14-17-37-93-66(96)31-32-67(93)97/h23-32,50-54,58,60,62-64,68-69,94H,11-22,33-49H2,1-10H3,(H,82,105)(H,83,99)(H,84,100)(H,85,102)(H,87,95)(H,88,101)(H,89,98)(H,90,106)(H3,80,81,104)/t53-,54-,58+,60-,62+,63+,64+,68-,69-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 98n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303129
PNG
(US10137202, Compound TAM467)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)C(NC(=O)[C@H]1CCCCN1C(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)OC)Cc1ccc(O)cc1
Show InChI InChI=1S/C70H103N11O15S/c1-11-34-79(55(43(4)5)40-56(95-37-12-2)66-76-53(42-97-66)63(87)74-50(38-46(9)68(91)94-10)39-47-25-29-51(82)30-26-47)67(90)61(45(8)13-3)78-64(88)54-21-16-18-35-80(54)70(93)96-41-48-23-27-49(28-24-48)73-62(86)52(20-19-33-72-69(71)92)75-65(89)60(44(6)7)77-57(83)22-15-14-17-36-81-58(84)31-32-59(81)85/h23-32,42-46,50,52,54-56,60-61,82H,11-22,33-41H2,1-10H3,(H,73,86)(H,74,87)(H,75,89)(H,77,83)(H,78,88)(H3,71,72,92)/t45-,46-,50+,52-,54+,55+,56+,60-,61?/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 325n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
cell proliferation arrest on HT1080 cells (CPA; crystal violet).


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303139
PNG
(US10137202, Compound TAM558)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCOCCOCCNC(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccc(O)cc1
Show InChI InChI=1S/C79H122N14O19S/c1-11-35-92(76(103)69(53(8)13-3)88-73(101)62-21-16-18-36-91(62)10)63(51(4)5)48-64(110-38-12-2)75-86-61(50-113-75)72(100)84-58(47-55-25-29-59(94)30-26-55)46-54(9)70(98)89-90-79(106)111-45-44-109-43-42-108-41-40-107-39-34-82-78(105)112-49-56-23-27-57(28-24-56)83-71(99)60(20-19-33-81-77(80)104)85-74(102)68(52(6)7)87-65(95)22-15-14-17-37-93-66(96)31-32-67(93)97/h23-32,50-54,58,60,62-64,68-69,94H,11-22,33-49H2,1-10H3,(H,82,105)(H,83,99)(H,84,100)(H,85,102)(H,87,95)(H,88,101)(H,89,98)(H,90,106)(H3,80,81,104)/t53-,54-,58+,60-,62+,63+,64+,68-,69-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.90E+3n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
TPI; Tubulin Polymerization assay kit; Cytoskeleton, Cat. #BK011P.


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303132
PNG
(US10137202, Compound TAM552)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCOCCOCCNC(=O)CCCCCN1C(=O)C=CC1=O)Cc1ccc(O)cc1
Show InChI InChI=1S/C60H95N9O14S/c1-9-26-68(59(77)54(42(6)11-3)64-57(76)48-17-14-16-27-67(48)8)49(41(4)5)39-50(82-29-10-2)58-63-47(40-84-58)56(75)62-45(38-44-19-21-46(70)22-20-44)37-43(7)55(74)65-66-60(78)83-36-35-81-34-33-80-32-31-79-30-25-61-51(71)18-13-12-15-28-69-52(72)23-24-53(69)73/h19-24,40-43,45,48-50,54,70H,9-18,25-39H2,1-8H3,(H,61,71)(H,62,75)(H,64,76)(H,65,74)(H,66,78)/t42-,43-,45+,48+,49+,50+,54-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.90E+3n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
TPI; Tubulin Polymerization assay kit; Cytoskeleton, Cat. #BK011P.


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303138
PNG
(US10137202, Compound TAM553)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCCOCCNC(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccccc1
Show InChI InChI=1S/C75H114N14O16S/c1-11-36-88(72(98)65(50(8)13-3)84-69(96)58-26-19-21-37-87(58)10)59(48(4)5)45-60(103-39-12-2)71-82-57(47-106-71)68(95)80-55(44-52-23-16-14-17-24-52)43-51(9)66(93)85-86-75(101)104-42-41-102-40-35-78-74(100)105-46-53-28-30-54(31-29-53)79-67(94)56(25-22-34-77-73(76)99)81-70(97)64(49(6)7)83-61(90)27-18-15-20-38-89-62(91)32-33-63(89)92/h14,16-17,23-24,28-33,47-51,55-56,58-60,64-65H,11-13,15,18-22,25-27,34-46H2,1-10H3,(H,78,100)(H,79,94)(H,80,95)(H,81,97)(H,83,90)(H,84,96)(H,85,93)(H,86,101)(H3,76,77,99)/t50-,51-,55+,56-,58+,59+,60+,64-,65-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6.00E+3n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
TPI; Tubulin Polymerization assay kit; Cytoskeleton, Cat. #BK011P.


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303131
PNG
(US10137202, Compound TAM471)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)[C@@H](NC(=O)[C@H]1CCCCN1C)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)NNC(=O)OCc1ccc(NC(=O)[C@@H](CCCNC(N)=O)NC(=O)[C@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)Cc1ccc(O)cc1
Show InChI InChI=1S/C70H105N13O14S/c1-11-34-82(68(93)61(45(8)13-3)78-65(91)54-21-16-18-35-81(54)10)55(43(4)5)40-56(96-37-12-2)67-76-53(42-98-67)64(90)74-50(39-47-25-29-51(84)30-26-47)38-46(9)62(88)79-80-70(95)97-41-48-23-27-49(28-24-48)73-63(89)52(20-19-33-72-69(71)94)75-66(92)60(44(6)7)77-57(85)22-15-14-17-36-83-58(86)31-32-59(83)87/h23-32,42-46,50,52,54-56,60-61,84H,11-22,33-41H2,1-10H3,(H,73,89)(H,74,90)(H,75,92)(H,77,85)(H,78,91)(H,79,88)(H,80,95)(H3,71,72,94)/t45-,46-,50+,52+,54+,55+,56+,60+,61-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.40E+4n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
TPI; Tubulin Polymerization assay kit; Cytoskeleton, Cat. #BK011P.


US Patent US10137202 (2018)

More data for this
Ligand-Target Pair
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM303129
PNG
(US10137202, Compound TAM467)
Show SMILES CCCO[C@H](C[C@H](C(C)C)N(CCC)C(=O)C(NC(=O)[C@H]1CCCCN1C(=O)OCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN2C(=O)C=CC2=O)C(C)C)cc1)[C@@H](C)CC)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(=O)OC)Cc1ccc(O)cc1
Show InChI InChI=1S/C70H103N11O15S/c1-11-34-79(55(43(4)5)40-56(95-37-12-2)66-76-53(42-97-66)63(87)74-50(38-46(9)68(91)94-10)39-47-25-29-51(82)30-26-47)67(90)61(45(8)13-3)78-64(88)54-21-16-18-35-80(54)70(93)96-41-48-23-27-49(28-24-48)73-62(86)52(20-19-33-72-69(71)92)75-65(89)60(44(6)7)77-57(83)22-15-14-17-36-81-58(84)31-32-59(81)85/h23-32,42-46,50,52,54-56,60-61,82H,11-22,33-41H2,1-10H3,(H,73,86)(H,74,87)(H,75,89)(H,77,83)(H,78,88)(H3,71,72,92)/t45-,46-,50+,52-,54+,55+,56+,60-,61?/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.50E+5n/an/an/an/an/an/a



Oncomatryx Biopharma, S.L.

US Patent


Assay Description
TPI; Tubulin Polymerization assay kit; Cytoskeleton, Cat. #BK011P.


US Patent US10137202 (2018)

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