Found 99 hits with Last Name = 'blom' and Initial = 'd' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319102
(5-(3,5-difluorophenyl)-2-(3-(6-hydroxynaphthalen-2...)Show SMILES OC(=O)C1=C(CCC(C1)c1cc(F)cc(F)c1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H23F2NO4/c27-20-10-19(11-21(28)14-20)18-5-7-24(23(13-18)26(32)33)29-25(31)8-2-15-1-3-17-12-22(30)6-4-16(17)9-15/h1,3-4,6,9-12,14,18,30H,2,5,7-8,13H2,(H,29,31)(H,32,33) | PDB
Reactome pathway
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| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50281756
((S)-5-Diphenylacetyl-1-(3-methyl-4-{6-[3-(7-nitro-...)Show SMILES Cc1cc(Cn2cnc3CN(C(Cc23)C(O)=O)C(=O)C(c2ccccc2)c2ccccc2)ccc1NCCCCCCNC(=O)CCNc1ccc([N+]([O-])=O)c2[n-][o+]nc12 Show InChI InChI=1S/C44H47N9O7/c1-29-24-30(16-17-33(29)45-21-10-2-3-11-22-47-39(54)20-23-46-34-18-19-36(53(58)59)42-41(34)49-60-50-42)26-51-28-48-35-27-52(38(44(56)57)25-37(35)51)43(55)40(31-12-6-4-7-13-31)32-14-8-5-9-15-32/h4-9,12-19,24,28,38,40,45-46H,2-3,10-11,20-23,25-27H2,1H3,(H,47,54)(H,56,57) | PDB
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PC cid
PC sid
UniChem
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| Article
| n/a | n/a | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
The compound was evaluated for the inhibition of binding of [125I]-CGP 42112A to AT2 receptor |
Bioorg Med Chem Lett 3: 905-908 (1993)
Article DOI: 10.1016/S0960-894X(00)80690-3
BindingDB Entry DOI: 10.7270/Q24T6JV7 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319109
(2-(3-(3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-...)Show SMILES CCCC1CCC(NC(=O)CCc2nc(no2)-c2ccc(O)cn2)=C(C1)C(O)=O |c:25| Show InChI InChI=1S/C20H24N4O5/c1-2-3-12-4-6-15(14(10-12)20(27)28)22-17(26)8-9-18-23-19(24-29-18)16-7-5-13(25)11-21-16/h5,7,11-12,25H,2-4,6,8-10H2,1H3,(H,22,26)(H,27,28) | PDB
Reactome pathway
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PC sid
UniChem
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50313977
(2-(3-(3-(5-hydroxypyridin-2-yl)-1,2,4-oxadiazol-5-...)Show SMILES OC(=O)C1=C(CCCC1)NC(=O)CCc1nc(no1)-c1ccc(O)cn1 |t:3| Show InChI InChI=1S/C17H18N4O5/c22-10-5-6-13(18-9-10)16-20-15(26-21-16)8-7-14(23)19-12-4-2-1-3-11(12)17(24)25/h5-6,9,22H,1-4,7-8H2,(H,19,23)(H,24,25) | PDB
Reactome pathway
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PC sid
UniChem
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| Article
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| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50281755
((S)-5-Diphenylacetyl-1-(4-hydroxy-3-iodo-5-methyl-...)Show SMILES Cc1cc(Cn2cnc3CN([C@@H](Cc23)C(O)=O)C(=O)C(c2ccccc2)c2ccccc2)cc(I)c1O Show InChI InChI=1S/C29H26IN3O4/c1-18-12-19(13-22(30)27(18)34)15-32-17-31-23-16-33(25(29(36)37)14-24(23)32)28(35)26(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,17,25-26,34H,14-16H2,1H3,(H,36,37)/t25-/m0/s1 | PDB
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| n/a | n/a | 5.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
The compound was evaluated for the inhibition of binding of [125I]-CGP 42112A to AT2 receptor |
Bioorg Med Chem Lett 3: 905-908 (1993)
Article DOI: 10.1016/S0960-894X(00)80690-3
BindingDB Entry DOI: 10.7270/Q24T6JV7 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319123
((4S,5R)-2-(3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadi...)Show SMILES C[C@H]1CC(NC(=O)CCc2nc(no2)-c2ccc(F)cn2)=C(C[C@H]1c1cc(F)cc(F)c1F)C(O)=O |r,c:22| Show InChI InChI=1S/C24H20F4N4O4/c1-11-6-19(16(24(34)35)9-14(11)15-7-13(26)8-17(27)22(15)28)30-20(33)4-5-21-31-23(32-36-21)18-3-2-12(25)10-29-18/h2-3,7-8,10-11,14H,4-6,9H2,1H3,(H,30,33)(H,34,35)/t11-,14+/m0/s1 | PDB
Reactome pathway
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319096
(5-butyl-2-(3-(6-hydroxynaphthalen-2-yl)propanamido...)Show SMILES CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:25| Show InChI InChI=1S/C24H29NO4/c1-2-3-4-16-6-11-22(21(14-16)24(28)29)25-23(27)12-7-17-5-8-19-15-20(26)10-9-18(19)13-17/h5,8-10,13,15-16,26H,2-4,6-7,11-12,14H2,1H3,(H,25,27)(H,28,29) | PDB
Reactome pathway
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PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50281758
((S)-1-[4-(6-{(S)-2-Amino-6-[5-((3aR,6S,6aS)-2-oxo-...)Show SMILES Cc1cc(Cn2cnc3CN([C@@H](Cc23)C(O)=O)C(=O)C(c2ccccc2)c2ccccc2)ccc1NCCCCCCNC(=O)[C@@H](N)CCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 Show InChI InChI=1S/C51H67N9O6S/c1-34-28-35(30-59-33-56-40-31-60(43(50(64)65)29-42(40)59)49(63)46(36-16-6-4-7-17-36)37-18-8-5-9-19-37)23-24-39(34)53-25-13-2-3-14-27-55-48(62)38(52)20-12-15-26-54-45(61)22-11-10-21-44-47-41(32-67-44)57-51(66)58-47/h4-9,16-19,23-24,28,33,38,41,43-44,46-47,53H,2-3,10-15,20-22,25-27,29-32,52H2,1H3,(H,54,61)(H,55,62)(H,64,65)(H2,57,58,66)/t38-,41-,43-,44-,47-/m0/s1 | PDB
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UniChem
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| Article
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
The compound was evaluated for the inhibition of binding of [125I]-CGP 42112A to AT2 receptor |
Bioorg Med Chem Lett 3: 905-908 (1993)
Article DOI: 10.1016/S0960-894X(00)80690-3
BindingDB Entry DOI: 10.7270/Q24T6JV7 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319110
(5-(3-fluorophenyl)-2-(3-(3-(5-hydroxypyridin-2-yl)...)Show SMILES OC(=O)C1=C(CCC(C1)c1cccc(F)c1)NC(=O)CCc1nc(no1)-c1ccc(O)cn1 |t:3| Show InChI InChI=1S/C23H21FN4O5/c24-15-3-1-2-13(10-15)14-4-6-18(17(11-14)23(31)32)26-20(30)8-9-21-27-22(28-33-21)19-7-5-16(29)12-25-19/h1-3,5,7,10,12,14,29H,4,6,8-9,11H2,(H,26,30)(H,31,32) | PDB
Reactome pathway
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PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319100
(5-(3-fluorophenyl)-2-(3-(6-hydroxynaphthalen-2-yl)...)Show SMILES OC(=O)C1=C(CCC(C1)c1cccc(F)c1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H24FNO4/c27-21-3-1-2-17(13-21)20-8-10-24(23(15-20)26(31)32)28-25(30)11-5-16-4-6-19-14-22(29)9-7-18(19)12-16/h1-4,6-7,9,12-14,20,29H,5,8,10-11,15H2,(H,28,30)(H,31,32) | PDB
Reactome pathway
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| n/a | n/a | 7.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50271314
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)cyclohe...)Show SMILES OC(=O)C1=C(CCCC1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C20H21NO4/c22-16-9-8-14-11-13(5-7-15(14)12-16)6-10-19(23)21-18-4-2-1-3-17(18)20(24)25/h5,7-9,11-12,22H,1-4,6,10H2,(H,21,23)(H,24,25) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319113
((4S,5R)-5-(3-fluorophenyl)-2-(3-(3-(5-hydroxypyrid...)Show SMILES C[C@H]1CC(NC(=O)CCc2nc(no2)-c2ccc(O)cn2)=C(C[C@H]1c1cccc(F)c1)C(O)=O |r,c:22| Show InChI InChI=1S/C24H23FN4O5/c1-13-9-20(18(24(32)33)11-17(13)14-3-2-4-15(25)10-14)27-21(31)7-8-22-28-23(29-34-22)19-6-5-16(30)12-26-19/h2-6,10,12-13,17,30H,7-9,11H2,1H3,(H,27,31)(H,32,33)/t13-,17+/m0/s1 | PDB
Reactome pathway
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| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319095
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-prop...)Show SMILES CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:24| Show InChI InChI=1S/C23H27NO4/c1-2-3-15-5-10-21(20(13-15)23(27)28)24-22(26)11-6-16-4-7-18-14-19(25)9-8-17(18)12-16/h4,7-9,12,14-15,25H,2-3,5-6,10-11,13H2,1H3,(H,24,26)(H,27,28) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50282396
((S)-1-(4-Dimethylamino-3-methyl-benzyl)-5-diphenyl...)Show SMILES CN(C)c1ccc(Cn2cnc3CN([C@@H](Cc23)C(O)=O)C(=O)C(c2ccccc2)c2ccccc2)cc1C Show InChI InChI=1S/C31H32N4O3/c1-21-16-22(14-15-26(21)33(2)3)18-34-20-32-25-19-35(28(31(37)38)17-27(25)34)30(36)29(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-16,20,28-29H,17-19H2,1-3H3,(H,37,38)/t28-/m0/s1 | PDB
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Similars
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| n/a | n/a | 8.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
The compound was evaluated for the inhibition of binding of [125I]-CGP 42112A to AT2 receptor |
Bioorg Med Chem Lett 3: 905-908 (1993)
Article DOI: 10.1016/S0960-894X(00)80690-3
BindingDB Entry DOI: 10.7270/Q24T6JV7 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319101
(5-(4-fluorophenyl)-2-(3-(6-hydroxynaphthalen-2-yl)...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccc(F)cc1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H24FNO4/c27-21-8-4-17(5-9-21)20-7-11-24(23(15-20)26(31)32)28-25(30)12-2-16-1-3-19-14-22(29)10-6-18(19)13-16/h1,3-6,8-10,13-14,20,29H,2,7,11-12,15H2,(H,28,30)(H,31,32) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 8.60 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319120
(2-(3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-y...)Show SMILES OC(=O)C1=C(CCC(C1)c1cc(F)cc(F)c1F)NC(=O)CCc1nc(no1)-c1ccc(F)cn1 |t:3| Show InChI InChI=1S/C23H18F4N4O4/c24-12-2-4-18(28-10-12)22-30-20(35-31-22)6-5-19(32)29-17-3-1-11(7-15(17)23(33)34)14-8-13(25)9-16(26)21(14)27/h2,4,8-11H,1,3,5-7H2,(H,29,32)(H,33,34) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319111
(5-(6-fluoropyridin-3-yl)-2-(3-(3-(5-hydroxypyridin...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccc(F)nc1)NC(=O)CCc1nc(no1)-c1ccc(O)cn1 |t:3| Show InChI InChI=1S/C22H20FN5O5/c23-18-6-2-13(10-25-18)12-1-4-16(15(9-12)22(31)32)26-19(30)7-8-20-27-21(28-33-20)17-5-3-14(29)11-24-17/h2-3,5-6,10-12,29H,1,4,7-9H2,(H,26,30)(H,31,32) | PDB
Reactome pathway
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UniChem
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PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319099
(5-(2-fluorophenyl)-2-(3-(6-hydroxynaphthalen-2-yl)...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccccc1F)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H24FNO4/c27-23-4-2-1-3-21(23)19-9-11-24(22(15-19)26(31)32)28-25(30)12-6-16-5-7-18-14-20(29)10-8-17(18)13-16/h1-5,7-8,10,13-14,19,29H,6,9,11-12,15H2,(H,28,30)(H,31,32) | PDB
Reactome pathway
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UniChem
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PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319112
((4S,5R)-2-(3-(3-(5-hydroxypyridin-2-yl)-1,2,4-oxad...)Show SMILES C[C@H]1CC(NC(=O)CCc2nc(no2)-c2ccc(O)cn2)=C(C[C@H]1c1cc(F)cc(F)c1F)C(O)=O |r,c:22| Show InChI InChI=1S/C24H21F3N4O5/c1-11-6-19(16(24(34)35)9-14(11)15-7-12(25)8-17(26)22(15)27)29-20(33)4-5-21-30-23(31-36-21)18-3-2-13(32)10-28-18/h2-3,7-8,10-11,14,32H,4-6,9H2,1H3,(H,29,33)(H,34,35)/t11-,14+/m0/s1 | PDB
Reactome pathway
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319106
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-(1-m...)Show SMILES Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:28| Show InChI InChI=1S/C24H25N3O4/c1-27-22(10-11-25-27)18-6-8-21(20(14-18)24(30)31)26-23(29)9-3-15-2-4-17-13-19(28)7-5-16(17)12-15/h2,4-5,7,10-13,18,28H,3,6,8-9,14H2,1H3,(H,26,29)(H,30,31) | PDB
Reactome pathway
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UniChem
| Article
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319121
(2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadi...)Show SMILES NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CC(CC1)c1cc(F)cc(F)c1F)C(O)=O |t:20| Show InChI InChI=1S/C23H19F4N5O4/c24-11-2-4-18(29-9-11)21-31-19(36-32-21)8-16(28)22(33)30-17-3-1-10(5-14(17)23(34)35)13-6-12(25)7-15(26)20(13)27/h2,4,6-7,9-10,16H,1,3,5,8,28H2,(H,30,33)(H,34,35) | PDB
Reactome pathway
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UniChem
Similars
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PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319104
(5-(6-fluoropyridin-3-yl)-2-(3-(6-hydroxynaphthalen...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccc(F)nc1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C25H23FN2O4/c26-23-9-6-19(14-27-23)18-5-8-22(21(13-18)25(31)32)28-24(30)10-2-15-1-3-17-12-20(29)7-4-16(17)11-15/h1,3-4,6-7,9,11-12,14,18,29H,2,5,8,10,13H2,(H,28,30)(H,31,32) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319105
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-(6-(...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccc(nc1)C(F)(F)F)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H23F3N2O4/c27-26(28,29)23-9-6-19(14-30-23)18-5-8-22(21(13-18)25(34)35)31-24(33)10-2-15-1-3-17-12-20(32)7-4-16(17)11-15/h1,3-4,6-7,9,11-12,14,18,32H,2,5,8,10,13H2,(H,31,33)(H,34,35) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319118
(5-(3,5-difluorophenyl)-2-(3-(3-(5-fluoropyridin-2-...)Show SMILES OC(=O)C1=C(CCC(C1)c1cc(F)cc(F)c1)NC(=O)CCc1nc(no1)-c1ccc(F)cn1 |t:3| Show InChI InChI=1S/C23H19F3N4O4/c24-14-2-4-19(27-11-14)22-29-21(34-30-22)6-5-20(31)28-18-3-1-12(9-17(18)23(32)33)13-7-15(25)10-16(26)8-13/h2,4,7-8,10-12H,1,3,5-6,9H2,(H,28,31)(H,32,33) | PDB
Reactome pathway
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319119
(2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadi...)Show SMILES NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CC(CC1)c1cc(F)cc(F)c1)C(O)=O |t:20| Show InChI InChI=1S/C23H20F3N5O4/c24-13-2-4-19(28-10-13)21-30-20(35-31-21)9-17(27)22(32)29-18-3-1-11(7-16(18)23(33)34)12-5-14(25)8-15(26)6-12/h2,4-6,8,10-11,17H,1,3,7,9,27H2,(H,29,32)(H,33,34) | PDB
Reactome pathway
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PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319115
(2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadi...)Show SMILES NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CCCC1)C(O)=O |t:20| Show InChI InChI=1S/C17H18FN5O4/c18-9-5-6-13(20-8-9)15-22-14(27-23-15)7-11(19)16(24)21-12-4-2-1-3-10(12)17(25)26/h5-6,8,11H,1-4,7,19H2,(H,21,24)(H,25,26) | PDB
Reactome pathway
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| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319097
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-phen...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccccc1)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C26H25NO4/c28-22-11-9-19-14-17(6-8-20(19)15-22)7-13-25(29)27-24-12-10-21(16-23(24)26(30)31)18-4-2-1-3-5-18/h1-6,8-9,11,14-15,21,28H,7,10,12-13,16H2,(H,27,29)(H,30,31) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
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PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319114
(2-(3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-y...)Show SMILES OC(=O)C1=C(CCCC1)NC(=O)CCc1nc(no1)-c1ccc(F)cn1 |t:3| Show InChI InChI=1S/C17H17FN4O4/c18-10-5-6-13(19-9-10)16-21-15(26-22-16)8-7-14(23)20-12-4-2-1-3-11(12)17(24)25/h5-6,9H,1-4,7-8H2,(H,20,23)(H,24,25) | PDB
Reactome pathway
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Similars
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PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319108
(5-(2-fluoropyridin-3-yl)-2-(3-(4'-hydroxybiphenyl-...)Show SMILES OC(=O)C1=C(CCC(C1)c1cccnc1F)NC(=O)CCc1ccc(cc1)-c1ccc(O)cc1 |t:3| Show InChI InChI=1S/C27H25FN2O4/c28-26-22(2-1-15-29-26)20-10-13-24(23(16-20)27(33)34)30-25(32)14-5-17-3-6-18(7-4-17)19-8-11-21(31)12-9-19/h1-4,6-9,11-12,15,20,31H,5,10,13-14,16H2,(H,30,32)(H,33,34) | PDB
Reactome pathway
KEGG
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UniChem
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PubMed
| n/a | n/a | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319094
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-meth...)Show SMILES CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:22| Show InChI InChI=1S/C21H23NO4/c1-13-2-8-19(18(10-13)21(25)26)22-20(24)9-4-14-3-5-16-12-17(23)7-6-15(16)11-14/h3,5-7,11-13,23H,2,4,8-10H2,1H3,(H,22,24)(H,25,26) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319103
(5-(2-fluoropyridin-3-yl)-2-(3-(6-hydroxynaphthalen...)Show SMILES OC(=O)C1=C(CCC(C1)c1cccnc1F)NC(=O)CCc1ccc2cc(O)ccc2c1 |t:3| Show InChI InChI=1S/C25H23FN2O4/c26-24-20(2-1-11-27-24)18-7-9-22(21(14-18)25(31)32)28-23(30)10-4-15-3-5-17-13-19(29)8-6-16(17)12-15/h1-3,5-6,8,11-13,18,29H,4,7,9-10,14H2,(H,28,30)(H,31,32) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
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PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319116
(5-(3-fluorophenyl)-2-(3-(3-(5-fluoropyridin-2-yl)-...)Show SMILES OC(=O)C1=C(CCC(C1)c1cccc(F)c1)NC(=O)CCc1nc(no1)-c1ccc(F)cn1 |t:3| Show InChI InChI=1S/C23H20F2N4O4/c24-15-3-1-2-13(10-15)14-4-6-18(17(11-14)23(31)32)27-20(30)8-9-21-28-22(29-33-21)19-7-5-16(25)12-26-19/h1-3,5,7,10,12,14H,4,6,8-9,11H2,(H,27,30)(H,31,32) | PDB
Reactome pathway
KEGG
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PC sid
UniChem
Similars
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PubMed
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50298000
((+/-)-5-(2,3,5-trifluorophenyl)-4,5,6,7-tetrahydro...)Show InChI InChI=1S/C14H11F3N2O2/c15-7-4-8(12(17)10(16)5-7)6-1-2-11-9(3-6)13(14(20)21)19-18-11/h4-6H,1-3H2,(H,18,19)(H,20,21) | PDB
Reactome pathway
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| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319117
(2-(2-amino-3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadi...)Show SMILES NC(Cc1nc(no1)-c1ccc(F)cn1)C(=O)NC1=C(CC(CC1)c1cccc(F)c1)C(O)=O |t:20| Show InChI InChI=1S/C23H21F2N5O4/c24-14-3-1-2-12(8-14)13-4-6-18(16(9-13)23(32)33)28-22(31)17(26)10-20-29-21(30-34-20)19-7-5-15(25)11-27-19/h1-3,5,7-8,11,13,17H,4,6,9-10,26H2,(H,28,31)(H,32,33) | PDB
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| n/a | n/a | 85 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50297999
((+/-)-5-(2,5-difluorophenyl)-4,5,6,7-tetrahydro-1H...)Show InChI InChI=1S/C14H12F2N2O2/c15-8-2-3-11(16)9(6-8)7-1-4-12-10(5-7)13(14(19)20)18-17-12/h2-3,6-7H,1,4-5H2,(H,17,18)(H,19,20) | PDB
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| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319107
(2-(3-(6-hydroxynaphthalen-2-yl)propanamido)-5-(1-m...)Show SMILES Cn1cc(cn1)C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:28| Show InChI InChI=1S/C24H25N3O4/c1-27-14-19(13-25-27)18-6-8-22(21(12-18)24(30)31)26-23(29)9-3-15-2-4-17-11-20(28)7-5-16(17)10-15/h2,4-5,7,10-11,13-14,18,28H,3,6,8-9,12H2,1H3,(H,26,29)(H,30,31) | PDB
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| n/a | n/a | 120 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM23515
(CHEMBL573 | Niacin | Nicotinic Acid | [5, 6-3H]-ni...)Show InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) | PDB
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Article
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| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM23515
(CHEMBL573 | Niacin | Nicotinic Acid | [5, 6-3H]-ni...)Show InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) | PDB
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PDB
Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in presence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM23515
(CHEMBL573 | Niacin | Nicotinic Acid | [5, 6-3H]-ni...)Show InChI InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9) | PDB
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PDB
Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50298002
((+/-)-5-(2,5-difluorophenyl)-3-(1H-tetrazol-5-yl)-...)Show SMILES Fc1ccc(F)c(c1)C1CCc2[nH]nc(c2C1)-c1nnn[nH]1 Show InChI InChI=1S/C14H12F2N6/c15-8-2-3-11(16)9(6-8)7-1-4-12-10(5-7)13(18-17-12)14-19-21-22-20-14/h2-3,6-7H,1,4-5H2,(H,17,18)(H,19,20,21,22) | PDB
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| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50378119
(CHEMBL1204125)Show SMILES Fc1ncccc1C1CCC2=C(C1)C(N=N2)=C1N=NN=N1 |c:11,16,20,22| Show InChI InChI=1S/C13H10FN7/c14-12-8(2-1-5-15-12)7-3-4-10-9(6-7)11(17-16-10)13-18-20-21-19-13/h1-2,5,7H,3-4,6H2 | PDB
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| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in presence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50378119
(CHEMBL1204125)Show SMILES Fc1ncccc1C1CCC2=C(C1)C(N=N2)=C1N=NN=N1 |c:11,16,20,22| Show InChI InChI=1S/C13H10FN7/c14-12-8(2-1-5-15-12)7-3-4-10-9(6-7)11(17-16-10)13-18-20-21-19-13/h1-2,5,7H,3-4,6H2 | PDB
Reactome pathway
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| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50298001
((+/-)-5-(2-fluoropyridin-3-yl)-4,5,6,7-tetrahydro-...)Show InChI InChI=1S/C13H12FN3O2/c14-12-8(2-1-5-15-12)7-3-4-10-9(6-7)11(13(18)19)17-16-10/h1-2,5,7H,3-4,6H2,(H,16,17)(H,18,19) | PDB
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| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50297999
((+/-)-5-(2,5-difluorophenyl)-4,5,6,7-tetrahydro-1H...)Show InChI InChI=1S/C14H12F2N2O2/c15-8-2-3-11(16)9(6-8)7-1-4-12-10(5-7)13(14(19)20)18-17-12/h2-3,6-7H,1,4-5H2,(H,17,18)(H,19,20) | PDB
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| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50297995
((+/-)-5-(2-fluorophenyl)-4,5,6,7-tetrahydro-1H-ind...)Show InChI InChI=1S/C14H13FN2O2/c15-11-4-2-1-3-9(11)8-5-6-12-10(7-8)13(14(18)19)17-16-12/h1-4,8H,5-7H2,(H,16,17)(H,18,19) | PDB
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| n/a | n/a | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319122
(2-(3-(3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-y...)Show SMILES OC(=O)C1=C(CCC(C1)c1ccc(F)nc1)NC(=O)CCc1nc(no1)-c1ccc(F)cn1 |t:3| Show InChI InChI=1S/C22H19F2N5O4/c23-14-3-5-17(25-11-14)21-28-20(33-29-21)8-7-19(30)27-16-4-1-12(9-15(16)22(31)32)13-2-6-18(24)26-10-13/h2-3,5-6,10-12H,1,4,7-9H2,(H,27,30)(H,31,32) | PDB
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| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50298001
((+/-)-5-(2-fluoropyridin-3-yl)-4,5,6,7-tetrahydro-...)Show InChI InChI=1S/C13H12FN3O2/c14-12-8(2-1-5-15-12)7-3-4-10-9(6-7)11(13(18)19)17-16-10/h1-2,5,7H,3-4,6H2,(H,16,17)(H,18,19) | PDB
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| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in presence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50297999
((+/-)-5-(2,5-difluorophenyl)-4,5,6,7-tetrahydro-1H...)Show InChI InChI=1S/C14H12F2N2O2/c15-8-2-3-11(16)9(6-8)7-1-4-12-10(5-7)13(14(19)20)18-17-12/h2-3,6-7H,1,4-5H2,(H,17,18)(H,19,20) | PDB
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| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in presence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50319098
(5-hydroxy-2-(3-(6-hydroxynaphthalen-2-yl)propanami...)Show SMILES OC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C1)C(O)=O |c:22| Show InChI InChI=1S/C20H21NO5/c22-15-5-4-13-9-12(1-3-14(13)10-15)2-8-19(24)21-18-7-6-16(23)11-17(18)20(25)26/h1,3-5,9-10,16,22-23H,2,6-8,11H2,(H,21,24)(H,25,26) | PDB
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| n/a | n/a | 420 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co.
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CHO-KI cells |
Bioorg Med Chem Lett 20: 3426-30 (2010)
Article DOI: 10.1016/j.bmcl.2010.04.001
BindingDB Entry DOI: 10.7270/Q2W0963X |
More data for this
Ligand-Target Pair | |
Hydroxycarboxylic acid receptor 2
(Homo sapiens (Human)) | BDBM50297997
((+/-)-5-(2-chlorophenyl)-4,5,6,7-tetrahydro-1H-ind...)Show InChI InChI=1S/C14H13ClN2O2/c15-11-4-2-1-3-9(11)8-5-6-12-10(7-8)13(14(18)19)17-16-12/h1-4,8H,5-7H2,(H,16,17)(H,18,19) | PDB
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| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Displacement of [3H]niacin from human niacin receptor expressed in CKO-K1 cells in absence of 5% human serum |
Bioorg Med Chem Lett 19: 4768-72 (2009)
Article DOI: 10.1016/j.bmcl.2009.06.054
BindingDB Entry DOI: 10.7270/Q2M909M3 |
More data for this
Ligand-Target Pair | |
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