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PubMed code 11086718

Compile data set for download or QSAR
Found 65 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
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093836
PNG
(CHEMBL310992 | {(S)-2-[(2S,3S)-2-(3,4-Dibromo-benz...)
Show SMILES CC[C@H](C)[C@H](NS(=O)(=O)c1ccc(Br)c(Br)c1)C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C23H28Br2N4O7S/c1-3-14(2)20(29-37(34,35)16-9-10-17(24)18(25)11-16)22(31)27-19(21(30)28-33)12-26-23(32)36-13-15-7-5-4-6-8-15/h4-11,14,19-20,29,33H,3,12-13H2,1-2H3,(H,26,32)(H,27,31)(H,28,30)/t14-,19-,20-/m0/s1
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n/an/a 26n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093871
PNG
((2R,3R)-2-(2,5-Dichloro-benzenesulfonylamino)-3-me...)
Show SMILES CC[C@@H](C)[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C18H22Cl2N4O5S2/c1-3-10(2)16(24-31(28,29)15-6-11(19)4-5-13(15)20)18(26)22-14(17(25)23-27)7-12-8-30-9-21-12/h4-6,8-10,14,16,24,27H,3,7H2,1-2H3,(H,22,26)(H,23,25)/t10-,14-,16-/m1/s1
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n/an/a 29n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093834
PNG
((2R,3R)-2-(3,4-Dibromo-benzenesulfonylamino)-3-met...)
Show SMILES CC[C@@H](C)[C@@H](NS(=O)(=O)c1ccc(Br)c(Br)c1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C18H22Br2N4O5S2/c1-3-10(2)16(24-31(28,29)12-4-5-13(19)14(20)7-12)18(26)22-15(17(25)23-27)6-11-8-30-9-21-11/h4-5,7-10,15-16,24,27H,3,6H2,1-2H3,(H,22,26)(H,23,25)/t10-,15-,16-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093840
PNG
((2S,3S)-2-(4,5-Dibromo-thiophene-2-sulfonylamino)-...)
Show SMILES CC[C@H](C)[C@H](NS(=O)(=O)c1cc(Br)c(Br)s1)C(=O)NC(Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C16H20Br2N4O5S3/c1-3-8(2)13(22-30(26,27)12-5-10(17)14(18)29-12)16(24)20-11(15(23)21-25)4-9-6-28-7-19-9/h5-8,11,13,22,25H,3-4H2,1-2H3,(H,20,24)(H,21,23)/t8-,11?,13-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093876
PNG
(CHEMBL83127 | {1-[(1S,2R)-1-((S)-1-Hydroxycarbamoy...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(CCSC)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C25H35N5O6S2/c1-4-16(2)21(24(33)27-20(23(32)30-35)12-18-14-38-15-26-18)29-22(31)19(10-11-37-3)28-25(34)36-13-17-8-6-5-7-9-17/h5-9,14-16,19-21,35H,4,10-13H2,1-3H3,(H,27,33)(H,28,34)(H,29,31)(H,30,32)/t16-,19?,20+,21+/m1/s1
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n/an/a 43n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093837
PNG
((2R,3R)-2-(4-Chloro-4,6-dimethyl-cyclohexa-1,5-die...)
Show SMILES CC[C@@H](C)[C@@H](NS(=O)(=O)C1=CCC(C)(Cl)C=C1C)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H29ClN4O5S2/c1-5-12(2)17(25-32(29,30)16-6-7-20(4,21)9-13(16)3)19(27)23-15(18(26)24-28)8-14-10-31-11-22-14/h6,9-12,15,17,25,28H,5,7-8H2,1-4H3,(H,23,27)(H,24,26)/t12-,15-,17-,20?/m1/s1
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n/an/a 43n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093869
PNG
(CHEMBL86076 | {1-[(1S,2R)-1-((S)-1-Hydroxycarbamoy...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C29H35N5O6S/c1-3-19(2)25(28(37)31-24(27(36)34-39)15-22-17-41-18-30-22)33-26(35)23(14-20-10-6-4-7-11-20)32-29(38)40-16-21-12-8-5-9-13-21/h4-13,17-19,23-25,39H,3,14-16H2,1-2H3,(H,31,37)(H,32,38)(H,33,35)(H,34,36)/t19-,23?,24+,25+/m1/s1
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n/an/a 44n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093872
PNG
((2R,3R)-3-Methyl-2-(2,4,5-trichloro-benzenesulfony...)
Show SMILES CC[C@@H](C)[C@@H](NS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C18H21Cl3N4O5S2/c1-3-9(2)16(25-32(29,30)15-6-12(20)11(19)5-13(15)21)18(27)23-14(17(26)24-28)4-10-7-31-8-22-10/h5-9,14,16,25,28H,3-4H2,1-2H3,(H,23,27)(H,24,26)/t9-,14-,16-/m1/s1
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n/an/a 49n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093873
PNG
(4-Chloro-N-(4-fluoro-benzyl)-N-{[(1R,2R)-1-((R)-1-...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1ccc(Cl)cc1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C27H31ClFN5O4S/c1-3-17(2)24(26(36)32-23(25(35)33-38)12-22-14-39-16-31-22)30-15-34(13-18-4-10-21(29)11-5-18)27(37)19-6-8-20(28)9-7-19/h4-11,14,16-17,23-24,30,38H,3,12-13,15H2,1-2H3,(H,32,36)(H,33,35)/t17-,23-,24-/m1/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093862
PNG
(CHEMBL83111 | {2-[2-(4,5-Dibromo-thiophene-2-sulfo...)
Show SMILES CC[C@H](C)[C@H](NS(=O)(=O)c1cc(Br)c(Br)s1)C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C21H26Br2N4O7S2/c1-3-12(2)17(27-36(32,33)16-9-14(22)18(23)35-16)20(29)25-15(19(28)26-31)10-24-21(30)34-11-13-7-5-4-6-8-13/h4-9,12,15,17,27,31H,3,10-11H2,1-2H3,(H,24,30)(H,25,29)(H,26,28)/t12-,15-,17-/m0/s1
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n/an/a 52n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093816
PNG
(3-Chloro-N-(4-fluoro-benzyl)-N-{[(1R,2R)-1-((R)-1-...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1cccc(Cl)c1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C27H31ClFN5O4S/c1-3-17(2)24(26(36)32-23(25(35)33-38)12-22-14-39-16-31-22)30-15-34(13-18-7-9-21(29)10-8-18)27(37)19-5-4-6-20(28)11-19/h4-11,14,16-17,23-24,30,38H,3,12-13,15H2,1-2H3,(H,32,36)(H,33,35)/t17-,23-,24-/m1/s1
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n/an/a 53n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093817
PNG
(CHEMBL81901 | [(1R,2R)-1-(2-Benzyloxycarbonylamino...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NCC(NC(=O)OCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C25H32N4O7/c1-3-17(2)21(28-25(33)36-16-19-12-8-5-9-13-19)23(31)26-14-20(22(30)29-34)27-24(32)35-15-18-10-6-4-7-11-18/h4-13,17,20-21,34H,3,14-16H2,1-2H3,(H,26,31)(H,27,32)(H,28,33)(H,29,30)/t17-,20?,21-/m1/s1
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n/an/a 61n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093850
PNG
(CHEMBL311222 | {(S)-2-[(2S,3S)-2-(2,5-Dichloro-ben...)
Show SMILES CC[C@H](C)[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C23H28Cl2N4O7S/c1-3-14(2)20(29-37(34,35)19-11-16(24)9-10-17(19)25)22(31)27-18(21(30)28-33)12-26-23(32)36-13-15-7-5-4-6-8-15/h4-11,14,18,20,29,33H,3,12-13H2,1-2H3,(H,26,32)(H,27,31)(H,28,30)/t14-,18-,20-/m0/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093821
PNG
(CHEMBL310772 | {(S)-2-[(2S,3S)-2-(4-Chloro-2,5-dim...)
Show SMILES CC[C@H](C)[C@H](NS(=O)(=O)c1cc(C)c(Cl)cc1C)C(=O)N[C@@H](CNC(=O)OCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C25H33ClN4O7S/c1-5-15(2)22(30-38(35,36)21-12-16(3)19(26)11-17(21)4)24(32)28-20(23(31)29-34)13-27-25(33)37-14-18-9-7-6-8-10-18/h6-12,15,20,22,30,34H,5,13-14H2,1-4H3,(H,27,33)(H,28,32)(H,29,31)/t15-,20-,22-/m0/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093826
PNG
(CHEMBL314390 | [1-[(1S,2R)-1-((S)-1-Hydroxycarbamo...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C31H36N6O6S/c1-3-19(2)27(30(40)34-26(29(39)37-42)14-22-17-44-18-33-22)36-28(38)25(13-21-15-32-24-12-8-7-11-23(21)24)35-31(41)43-16-20-9-5-4-6-10-20/h4-12,15,17-19,25-27,32,42H,3,13-14,16H2,1-2H3,(H,34,40)(H,35,41)(H,36,38)(H,37,39)/t19-,25?,26+,27+/m1/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093824
PNG
(CHEMBL315775 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H24Cl2N4O5S/c1-3-11(2)17(25-20(29)31-8-12-4-5-14(21)15(22)6-12)19(28)24-16(18(27)26-30)7-13-9-32-10-23-13/h4-6,9-11,16-17,30H,3,7-8H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)/t11-,16-,17-/m1/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093861
PNG
(CHEMBL85616 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1Br)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H25BrN4O5S/c1-3-12(2)17(24-20(28)30-9-13-6-4-5-7-15(13)21)19(27)23-16(18(26)25-29)8-14-10-31-11-22-14/h4-7,10-12,16-17,29H,3,8-9H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)/t12-,16-,17-/m1/s1
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n/an/a 78n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093860
PNG
(CHEMBL76215 | {2-Benzyloxy-1-[(1S,2R)-1-((S)-1-hyd...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(COCc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C30H37N5O7S/c1-3-20(2)26(29(38)32-24(28(37)35-40)14-23-18-43-19-31-23)34-27(36)25(17-41-15-21-10-6-4-7-11-21)33-30(39)42-16-22-12-8-5-9-13-22/h4-13,18-20,24-26,40H,3,14-17H2,1-2H3,(H,32,38)(H,33,39)(H,34,36)(H,35,37)/t20-,24+,25?,26+/m1/s1
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n/an/a 78n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093867
PNG
(CHEMBL314165 | {2-(4-Fluoro-phenyl)-1-[(1S,2R)-1-(...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(Cc1ccc(F)cc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C29H34FN5O6S/c1-3-18(2)25(28(38)32-24(27(37)35-40)14-22-16-42-17-31-22)34-26(36)23(13-19-9-11-21(30)12-10-19)33-29(39)41-15-20-7-5-4-6-8-20/h4-12,16-18,23-25,40H,3,13-15H2,1-2H3,(H,32,38)(H,33,39)(H,34,36)(H,35,37)/t18-,23?,24+,25+/m1/s1
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n/an/a 78n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093823
PNG
(4-Bromo-N-(4-fluoro-benzyl)-N-{[(1R,2R)-1-((R)-1-h...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1ccc(Br)cc1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C27H31BrFN5O4S/c1-3-17(2)24(26(36)32-23(25(35)33-38)12-22-14-39-16-31-22)30-15-34(13-18-4-10-21(29)11-5-18)27(37)19-6-8-20(28)9-7-19/h4-11,14,16-17,23-24,30,38H,3,12-13,15H2,1-2H3,(H,32,36)(H,33,35)/t17-,23-,24-/m1/s1
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n/an/a 89n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093841
PNG
(CHEMBL83839 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1cccc(c1)C(F)(F)F)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C21H25F3N4O5S/c1-3-12(2)17(19(30)26-16(18(29)28-32)8-15-10-34-11-25-15)27-20(31)33-9-13-5-4-6-14(7-13)21(22,23)24/h4-7,10-12,16-17,32H,3,8-9H2,1-2H3,(H,26,30)(H,27,31)(H,28,29)/t12-,16-,17-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093852
PNG
(4-Fluoro-N-(4-fluoro-benzyl)-N-{[(1R,2R)-1-((R)-1-...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1ccc(F)cc1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C27H31F2N5O4S/c1-3-17(2)24(26(36)32-23(25(35)33-38)12-22-14-39-16-31-22)30-15-34(13-18-4-8-20(28)9-5-18)27(37)19-6-10-21(29)11-7-19/h4-11,14,16-17,23-24,30,38H,3,12-13,15H2,1-2H3,(H,32,36)(H,33,35)/t17-,23-,24-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093849
PNG
(CHEMBL84287 | [(1R,2R)-1-(2-Benzylamino-2-hydroxyc...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NCC(NCc1ccccc1)C(=O)NO
Show InChI InChI=1S/C24H32N4O5/c1-3-17(2)21(27-24(31)33-16-19-12-8-5-9-13-19)23(30)26-15-20(22(29)28-32)25-14-18-10-6-4-7-11-18/h4-13,17,20-21,25,32H,3,14-16H2,1-2H3,(H,26,30)(H,27,31)(H,28,29)/t17-,20?,21-/m1/s1
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n/an/a 94n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093829
PNG
(CHEMBL433145 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H26N4O5S/c1-3-13(2)17(23-20(27)29-10-14-7-5-4-6-8-14)19(26)22-16(18(25)24-28)9-15-11-30-12-21-15/h4-8,11-13,16-17,28H,3,9-10H2,1-2H3,(H,22,26)(H,23,27)(H,24,25)/t13-,16-,17-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093829
PNG
(CHEMBL433145 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H26N4O5S/c1-3-13(2)17(23-20(27)29-10-14-7-5-4-6-8-14)19(26)22-16(18(25)24-28)9-15-11-30-12-21-15/h4-8,11-13,16-17,28H,3,9-10H2,1-2H3,(H,22,26)(H,23,27)(H,24,25)/t13-,16-,17-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093874
PNG
(CHEMBL84082 | {1-[(1S,2R)-1-((S)-1-Hydroxycarbamoy...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C26H37N5O6S/c1-5-17(4)22(25(34)28-21(24(33)31-36)12-19-14-38-15-27-19)30-23(32)20(11-16(2)3)29-26(35)37-13-18-9-7-6-8-10-18/h6-10,14-17,20-22,36H,5,11-13H2,1-4H3,(H,28,34)(H,29,35)(H,30,32)(H,31,33)/t17-,20?,21+,22+/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093842
PNG
(CHEMBL310851 | N-(4-Fluoro-benzyl)-N-{[(1R,2R)-1-(...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1cccc(C)c1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C28H34FN5O4S/c1-4-19(3)25(27(36)32-24(26(35)33-38)13-23-15-39-17-31-23)30-16-34(14-20-8-10-22(29)11-9-20)28(37)21-7-5-6-18(2)12-21/h5-12,15,17,19,24-25,30,38H,4,13-14,16H2,1-3H3,(H,32,36)(H,33,35)/t19-,24-,25-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093831
PNG
(CHEMBL83149 | {(1R,2R)-1-[2-(4-tert-Butoxy-phenyl)...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccc(OC(C)(C)C)cc1)C(=O)NO
Show InChI InChI=1S/C27H37N3O6/c1-6-18(2)23(29-26(33)35-17-20-10-8-7-9-11-20)25(32)28-22(24(31)30-34)16-19-12-14-21(15-13-19)36-27(3,4)5/h7-15,18,22-23,34H,6,16-17H2,1-5H3,(H,28,32)(H,29,33)(H,30,31)/t18-,22?,23-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093855
PNG
(4-tert-Butyl-N-(4-fluoro-benzyl)-N-{[(1R,2R)-1-((R...)
Show SMILES CC[C@@H](C)[C@@H](NCN(Cc1ccc(F)cc1)C(=O)c1ccc(cc1)C(C)(C)C)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C31H40FN5O4S/c1-6-20(2)27(29(39)35-26(28(38)36-41)15-25-17-42-19-34-25)33-18-37(16-21-7-13-24(32)14-8-21)30(40)22-9-11-23(12-10-22)31(3,4)5/h7-14,17,19-20,26-27,33,41H,6,15-16,18H2,1-5H3,(H,35,39)(H,36,38)/t20-,26-,27-/m1/s1
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n/an/a 140n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093835
PNG
(CHEMBL83735 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](Cc1cscn1)C(=O)NO
Show InChI InChI=1S/C20H24Cl2N4O5S/c1-3-11(2)17(25-20(29)31-8-12-4-13(21)6-14(22)5-12)19(28)24-16(18(27)26-30)7-15-9-32-10-23-15/h4-6,9-11,16-17,30H,3,7-8H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)/t11-,16-,17-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093847
PNG
(CHEMBL313477 | {(1R,2R)-1-[2-(2-Chloro-phenyl)-1-h...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccccc1Cl)C(=O)NO
Show InChI InChI=1S/C23H28ClN3O5/c1-3-15(2)20(26-23(30)32-14-16-9-5-4-6-10-16)22(29)25-19(21(28)27-31)13-17-11-7-8-12-18(17)24/h4-12,15,19-20,31H,3,13-14H2,1-2H3,(H,25,29)(H,26,30)(H,27,28)/t15-,19?,20-/m1/s1
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n/an/a 190n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093838
PNG
(CHEMBL311980 | {(1R,2R)-1-[(R)-2-(4-Bromo-phenyl)-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccc(Br)cc1)C(=O)NO
Show InChI InChI=1S/C23H28BrN3O5/c1-3-15(2)20(26-23(30)32-14-17-7-5-4-6-8-17)22(29)25-19(21(28)27-31)13-16-9-11-18(24)12-10-16/h4-12,15,19-20,31H,3,13-14H2,1-2H3,(H,25,29)(H,26,30)(H,27,28)/t15-,19-,20-/m1/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093854
PNG
(CHEMBL84762 | [(1R,2R)-1-(2-Biphenyl-4-yl-1-hydrox...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NC(Cc1ccc(cc1)-c1ccccc1)C(=O)NO
Show InChI InChI=1S/C29H33N3O5/c1-3-20(2)26(31-29(35)37-19-22-10-6-4-7-11-22)28(34)30-25(27(33)32-36)18-21-14-16-24(17-15-21)23-12-8-5-9-13-23/h4-17,20,25-26,36H,3,18-19H2,1-2H3,(H,30,34)(H,31,35)(H,32,33)/t20-,25?,26-/m1/s1
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Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093819
PNG
(CHEMBL84815 | {(1R,2R)-1-[(R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)NO
Show InChI InChI=1S/C23H28N4O7/c1-3-15(2)20(25-23(30)34-14-17-7-5-4-6-8-17)22(29)24-19(21(28)26-31)13-16-9-11-18(12-10-16)27(32)33/h4-12,15,19-20,31H,3,13-14H2,1-2H3,(H,24,29)(H,25,30)(H,26,28)/t15-,19-,20-/m1/s1
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n/an/a 200n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093830
PNG
(CHEMBL82622 | {(1R,2R)-1-[(R)-2-(5-Bromo-thiophen-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccc(Br)s1)C(=O)NO
Show InChI InChI=1S/C21H26BrN3O5S/c1-3-13(2)18(24-21(28)30-12-14-7-5-4-6-8-14)20(27)23-16(19(26)25-29)11-15-9-10-17(22)31-15/h4-10,13,16,18,29H,3,11-12H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)/t13-,16-,18-/m1/s1
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n/an/a 210n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093819
PNG
(CHEMBL84815 | {(1R,2R)-1-[(R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccc(cc1)[N+]([O-])=O)C(=O)NO
Show InChI InChI=1S/C23H28N4O7/c1-3-15(2)20(25-23(30)34-14-17-7-5-4-6-8-17)22(29)24-19(21(28)26-31)13-16-9-11-18(12-10-16)27(32)33/h4-12,15,19-20,31H,3,13-14H2,1-2H3,(H,24,29)(H,25,30)(H,26,28)/t15-,19-,20-/m1/s1
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n/an/a 220n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093851
PNG
(CHEMBL309647 | [(1R,2R)-1-((R)-1-Hydroxycarbamoyl-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1ccccn1)C(=O)NO
Show InChI InChI=1S/C22H28N4O5/c1-3-15(2)19(25-22(29)31-14-16-9-5-4-6-10-16)21(28)24-18(20(27)26-30)13-17-11-7-8-12-23-17/h4-12,15,18-19,30H,3,13-14H2,1-2H3,(H,24,28)(H,25,29)(H,26,27)/t15-,18-,19-/m1/s1
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n/an/a 220n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093877
PNG
(CHEMBL316411 | {(1R,2R)-1-[(R)-1-Hydroxycarbamoyl-...)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1cnc[nH]1)C(=O)NO
Show InChI InChI=1S/C20H27N5O5/c1-3-13(2)17(24-20(28)30-11-14-7-5-4-6-8-14)19(27)23-16(18(26)25-29)9-15-10-21-12-22-15/h4-8,10,12-13,16-17,29H,3,9,11H2,1-2H3,(H,21,22)(H,23,27)(H,24,28)(H,25,26)/t13-,16-,17-/m1/s1
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n/an/a 250n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093839
PNG
((2R,3S)-2-(3-Bromo-phenylamino)-3-methyl-pentanoic...)
Show SMILES CC[C@H](C)[C@@H](Nc1cccc(Br)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C23H27BrN4O3/c1-3-14(2)21(26-17-9-6-8-16(24)12-17)23(30)27-20(22(29)28-31)13-18-11-15-7-4-5-10-19(15)25-18/h4-12,14,20-21,25-26,31H,3,13H2,1-2H3,(H,27,30)(H,28,29)/t14-,20+,21+/m0/s1
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n/an/a 500n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093863
PNG
(CHEMBL84212 | {(1R,2S)-1-[(R)-1-Hydroxycarbamoyl-2...)
Show SMILES CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NO
Show InChI InChI=1S/C25H30N4O5/c1-3-16(2)22(28-25(32)34-15-17-9-5-4-6-10-17)24(31)27-21(23(30)29-33)13-18-14-26-20-12-8-7-11-19(18)20/h4-12,14,16,21-22,26,33H,3,13,15H2,1-2H3,(H,27,31)(H,28,32)(H,29,30)/t16-,21+,22+/m0/s1
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n/an/a 730n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093820
PNG
((2R,3S)-2-(3,4-Dichloro-phenylamino)-3-methyl-pent...)
Show SMILES CC[C@H](C)[C@@H](Nc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C23H26Cl2N4O3/c1-3-13(2)21(27-15-8-9-17(24)18(25)11-15)23(31)28-20(22(30)29-32)12-16-10-14-6-4-5-7-19(14)26-16/h4-11,13,20-21,26-27,32H,3,12H2,1-2H3,(H,28,31)(H,29,30)/t13-,20+,21+/m0/s1
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n/an/a 750n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093865
PNG
(CHEMBL313625 | {1-[(R)-1-Hydroxycarbamoyl-2-(1H-in...)
Show SMILES CCCC(NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NO
Show InChI InChI=1S/C24H28N4O5/c1-2-8-20(27-24(31)33-15-16-9-4-3-5-10-16)22(29)26-21(23(30)28-32)13-17-14-25-19-12-7-6-11-18(17)19/h3-7,9-12,14,20-21,25,32H,2,8,13,15H2,1H3,(H,26,29)(H,27,31)(H,28,30)/t20?,21-/m1/s1
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n/an/a 870n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093845
PNG
(CHEMBL432365 | {[(R)-1-Hydroxycarbamoyl-2-(1H-indo...)
Show SMILES ONC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C27H26N4O5/c32-25(31-35)23(15-20-16-28-22-14-8-7-13-21(20)22)29-26(33)24(19-11-5-2-6-12-19)30-27(34)36-17-18-9-3-1-4-10-18/h1-14,16,23-24,28,35H,15,17H2,(H,29,33)(H,30,34)(H,31,32)/t23-,24?/m1/s1
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n/an/a 1.20E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093828
PNG
(CHEMBL312424 | {1-[(R)-1-Hydroxycarbamoyl-2-(1H-in...)
Show SMILES CC(C)C(NC(=O)OCc1ccccc1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NO
Show InChI InChI=1S/C24H28N4O5/c1-15(2)21(27-24(31)33-14-16-8-4-3-5-9-16)23(30)26-20(22(29)28-32)12-17-13-25-19-11-7-6-10-18(17)19/h3-11,13,15,20-21,25,32H,12,14H2,1-2H3,(H,26,30)(H,27,31)(H,28,29)/t20-,21?/m1/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093870
PNG
((2R,3S)-3-Methyl-2-[3-(2-nitro-phenyl)-ureido]-pen...)
Show SMILES CC[C@H](C)[C@@H](NC(=O)Nc1ccccc1[N+]([O-])=O)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C24H28N6O6/c1-3-14(2)21(28-24(33)27-18-10-6-7-11-20(18)30(35)36)23(32)26-19(22(31)29-34)13-16-12-15-8-4-5-9-17(15)25-16/h4-12,14,19,21,25,34H,3,13H2,1-2H3,(H,26,32)(H,29,31)(H2,27,28,33)/t14-,19+,21+/m0/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093818
PNG
((2R,3S)-3-Methyl-2-(3-nitro-phenylamino)-pentanoic...)
Show SMILES CC[C@H](C)[C@@H](Nc1cccc(c1)[N+]([O-])=O)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C23H27N5O5/c1-3-14(2)21(25-16-8-6-9-18(12-16)28(32)33)23(30)26-20(22(29)27-31)13-17-11-15-7-4-5-10-19(15)24-17/h4-12,14,20-21,24-25,31H,3,13H2,1-2H3,(H,26,30)(H,27,29)/t14-,20+,21+/m0/s1
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n/an/a 2.50E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093859
PNG
((2R,3S)-3-Methyl-2-(3-trifluoromethyl-phenylamino)...)
Show SMILES CC[C@H](C)[C@@H](Nc1cccc(c1)C(F)(F)F)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C24H27F3N4O3/c1-3-14(2)21(29-17-9-6-8-16(12-17)24(25,26)27)23(33)30-20(22(32)31-34)13-18-11-15-7-4-5-10-19(15)28-18/h4-12,14,20-21,28-29,34H,3,13H2,1-2H3,(H,30,33)(H,31,32)/t14-,20+,21+/m0/s1
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n/an/a 2.80E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093857
PNG
(4-Benzyloxycarbonylamino-4-[(R)-1-hydroxycarbamoyl...)
Show SMILES ONC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(CCC(O)=O)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C24H26N4O7/c29-21(30)11-10-19(27-24(33)35-14-15-6-2-1-3-7-15)22(31)26-20(23(32)28-34)12-16-13-25-18-9-5-4-8-17(16)18/h1-9,13,19-20,25,34H,10-12,14H2,(H,26,31)(H,27,33)(H,28,32)(H,29,30)/t19?,20-/m1/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093827
PNG
((2R,3S)-2-(3-Chloro-phenylamino)-3-methyl-pentanoi...)
Show SMILES CC[C@H](C)[C@@H](Nc1cccc(Cl)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C23H27ClN4O3/c1-3-14(2)21(26-17-9-6-8-16(24)12-17)23(30)27-20(22(29)28-31)13-18-11-15-7-4-5-10-19(15)25-18/h4-12,14,20-21,25-26,31H,3,13H2,1-2H3,(H,27,30)(H,28,29)/t14-,20+,21+/m0/s1
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n/an/a 3.40E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093843
PNG
((2R,3S)-3-Methyl-2-(3-phenethyl-ureido)-pentanoic ...)
Show SMILES CC[C@H](C)[C@@H](NC(=O)NCCc1ccccc1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C26H33N5O4/c1-3-17(2)23(30-26(34)27-14-13-18-9-5-4-6-10-18)25(33)29-22(24(32)31-35)16-20-15-19-11-7-8-12-21(19)28-20/h4-12,15,17,22-23,28,35H,3,13-14,16H2,1-2H3,(H,29,33)(H,31,32)(H2,27,30,34)/t17-,22+,23+/m0/s1
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n/an/a 3.60E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093833
PNG
((2R,3S)-2-[3-(2-Chloro-phenyl)-ureido]-3-methyl-pe...)
Show SMILES CC[C@H](C)[C@@H](NC(=O)Nc1ccccc1Cl)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C24H28ClN5O4/c1-3-14(2)21(29-24(33)28-19-11-7-5-9-17(19)25)23(32)27-20(22(31)30-34)13-16-12-15-8-4-6-10-18(15)26-16/h4-12,14,20-21,26,34H,3,13H2,1-2H3,(H,27,32)(H,30,31)(H2,28,29,33)/t14-,20+,21+/m0/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093866
PNG
((2R,3S)-2-[3-(3,5-Dichloro-phenyl)-ureido]-3-methy...)
Show SMILES CC[C@H](C)[C@@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C24H27Cl2N5O4/c1-3-13(2)21(30-24(34)28-18-10-15(25)9-16(26)11-18)23(33)29-20(22(32)31-35)12-17-8-14-6-4-5-7-19(14)27-17/h4-11,13,20-21,27,35H,3,12H2,1-2H3,(H,29,33)(H,31,32)(H2,28,30,34)/t13-,20+,21+/m0/s1
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n/an/a 5.10E+3n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093846
PNG
(CHEMBL83212 | {2-Hydroxy-1-[1-hydroxycarbamoyl-2-(...)
Show SMILES CC(O)C(NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NO
Show InChI InChI=1S/C23H26N4O6/c1-14(28)20(26-23(31)33-13-15-7-3-2-4-8-15)22(30)25-19(21(29)27-32)11-16-12-24-18-10-6-5-9-17(16)18/h2-10,12,14,19-20,24,28,32H,11,13H2,1H3,(H,25,30)(H,26,31)(H,27,29)/t14?,19-,20?/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093839
PNG
((2R,3S)-2-(3-Bromo-phenylamino)-3-methyl-pentanoic...)
Show SMILES CC[C@H](C)[C@@H](Nc1cccc(Br)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C23H27BrN4O3/c1-3-14(2)21(26-17-9-6-8-16(24)12-17)23(30)27-20(22(29)28-31)13-18-11-15-7-4-5-10-19(15)25-18/h4-12,14,20-21,25-26,31H,3,13H2,1-2H3,(H,27,30)(H,28,29)/t14-,20+,21+/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093875
PNG
(CHEMBL3142487 | CHEMBL315154 | {1-[1-Hydroxycarbam...)
Show SMILES ONC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C28H28N4O5/c33-26(30-25(27(34)32-36)16-21-17-29-23-14-8-7-13-22(21)23)24(15-19-9-3-1-4-10-19)31-28(35)37-18-20-11-5-2-6-12-20/h1-14,17,24-25,29,36H,15-16,18H2,(H,30,33)(H,31,35)(H,32,34)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093856
PNG
(CHEMBL83983 | {1-[1-Hydroxycarbamoyl-2-(1H-indol-3...)
Show SMILES ONC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C28H28N4O5/c33-26(30-25(27(34)32-36)16-21-17-29-23-14-8-7-13-22(21)23)24(15-19-9-3-1-4-10-19)31-28(35)37-18-20-11-5-2-6-12-20/h1-14,17,24-25,29,36H,15-16,18H2,(H,30,33)(H,31,35)(H,32,34)/t24-,25+/m1/s1
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n/an/a 1.80E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093844
PNG
(CHEMBL83215 | [1-[1-Hydroxycarbamoyl-2-(1H-indol-3...)
Show SMILES ONC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C30H29N5O5/c36-28(33-27(29(37)35-39)15-21-17-32-25-13-7-5-11-23(21)25)26(14-20-16-31-24-12-6-4-10-22(20)24)34-30(38)40-18-19-8-2-1-3-9-19/h1-13,16-17,26-27,31-32,39H,14-15,18H2,(H,33,36)(H,34,38)(H,35,37)/t26?,27-/m0/s1
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n/an/a 1.90E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093853
PNG
(CHEMBL310345 | {3-[1-Hydroxycarbamoyl-2-(1H-indol-...)
Show SMILES ONC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CCCNC(=O)OCc1ccccc1
Show InChI InChI=1S/C23H26N4O5/c28-21(11-6-12-24-23(30)32-15-16-7-2-1-3-8-16)26-20(22(29)27-31)13-17-14-25-19-10-5-4-9-18(17)19/h1-5,7-10,14,20,25,31H,6,11-13,15H2,(H,24,30)(H,26,28)(H,27,29)/t20-/m0/s1
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n/an/a 1.90E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093864
PNG
(CHEMBL83145 | [1-[1-Hydroxycarbamoyl-2-(1H-indol-3...)
Show SMILES ONC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C28H28N4O6/c33-21-12-10-18(11-13-21)14-24(31-28(36)38-17-19-6-2-1-3-7-19)26(34)30-25(27(35)32-37)15-20-16-29-23-9-5-4-8-22(20)23/h1-13,16,24-25,29,33,37H,14-15,17H2,(H,30,34)(H,31,36)(H,32,35)/t24-,25+/m1/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093832
PNG
((S)-3-[(S)-3-Carbamoyl-1-(2-methylcarbamoyl-pyrrol...)
Show SMILES CNC(=O)C1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(O)=O)CC(=O)NO
Show InChI InChI=1S/C17H27N5O8/c1-19-16(28)11-3-2-6-22(11)17(29)10(4-5-12(18)23)20-15(27)9(8-14(25)26)7-13(24)21-30/h9-11,30H,2-8H2,1H3,(H2,18,23)(H,19,28)(H,20,27)(H,21,24)(H,25,26)/t9-,10-,11?/m0/s1
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n/an/a 2.20E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093825
PNG
(2-Acetylamino-N-[(S)-1-(hydroxycarbamoylmethyl-car...)
Show SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NO
Show InChI InChI=1S/C22H26N4O7/c1-13(27)24-19(11-15-4-8-17(29)9-5-15)22(32)25-18(21(31)23-12-20(30)26-33)10-14-2-6-16(28)7-3-14/h2-9,18-19,28-29,33H,10-12H2,1H3,(H,23,31)(H,24,27)(H,25,32)(H,26,30)/t18-,19-/m0/s1
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n/an/a 6.50E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093868
PNG
(CHEMBL278678 | [1-Hydroxycarbamoyl-2-(1H-indol-3-y...)
Show SMILES ONC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C19H19N3O4/c23-18(22-25)17(10-14-11-20-16-9-5-4-8-15(14)16)21-19(24)26-12-13-6-2-1-3-7-13/h1-9,11,17,20,25H,10,12H2,(H,21,24)(H,22,23)
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n/an/a 6.70E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093858
PNG
((S)-3-((S)-3-Carbamoyl-1-methylcarbamoyl-propylcar...)
Show SMILES CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(O)=O)CC(=O)NO
Show InChI InChI=1S/C12H20N4O7/c1-14-12(22)7(2-3-8(13)17)15-11(21)6(5-10(19)20)4-9(18)16-23/h6-7,23H,2-5H2,1H3,(H2,13,17)(H,14,22)(H,15,21)(H,16,18)(H,19,20)/t6-,7-/m0/s1
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n/an/a 6.80E+4n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093848
PNG
((S)-2-Acetylamino-N-hydroxycarbamoylmethyl-3-(4-hy...)
Show SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NO
Show InChI InChI=1S/C13H17N3O5/c1-8(17)15-11(13(20)14-7-12(19)16-21)6-9-2-4-10(18)5-3-9/h2-5,11,18,21H,6-7H2,1H3,(H,14,20)(H,15,17)(H,16,19)/t11-/m0/s1
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n/an/a 2.80E+5n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
Bone morphogenetic protein 1


(Homo sapiens)
BDBM50093822
PNG
((S)-2-Acetylamino-5-guanidino-pentanoic acid ((S)-...)
Show SMILES C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)NO
Show InChI InChI=1S/C11H22N6O4/c1-6(9(19)17-21)15-10(20)8(16-7(2)18)4-3-5-14-11(12)13/h6,8,21H,3-5H2,1-2H3,(H,15,20)(H,16,18)(H,17,19)(H4,12,13,14)/t6-,8-/m0/s1
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n/an/a>8.00E+5n/an/an/an/an/an/a



Roche Bioscience

Curated by ChEMBL


Assay Description
Inhibitory effect against Procollagen C-terminal proteinase


Bioorg Med Chem Lett 10: 2513-6 (2001)


Article DOI: 10.1016/s0960-894x(00)00525-4
BindingDB Entry DOI: 10.7270/Q2KP81F2
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%