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Compile Data Set for Download or QSAR

Found 22 hits with Last Name = 'nakagami' and Initial = 'y'   
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
Motilin receptor


(Homo sapiens (Human))
BDBM50599720
PNG
(CHEMBL525634 | H-Motilin)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(O)=O |r|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599739
PNG
(CHEMBL5181246)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cccc(c2)C(O)=O)CCN1 |r,wU:16.16,1.0,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.16,;-6,.39,;-6,-1.15,;-4.67,-1.92,;-3.33,-1.15,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.15,;-.67,.39,;.66,1.16,;2,.39,;2,-1.15,;.66,2.7,;2,3.47,;2,5.01,;3.33,5.77,;4.66,5,;4.67,3.47,;3.34,2.69,;6,2.7,;7.33,3.47,;6,1.16,;-7.33,1.16,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50255062
PNG
(CHEMBL465925 | {3-[4-((3R,5S)-3,5-Dimethyl-piperaz...)
Show SMILES C[C@H]1CN(Cc2ccc(cc2)-c2cccnc2C(=O)N2CCC(Cc3ccc(F)cc3)CC2)C[C@@H](C)N1 |r|
Show InChI InChI=1S/C31H37FN4O/c1-22-19-35(20-23(2)34-22)21-26-5-9-27(10-6-26)29-4-3-15-33-30(29)31(37)36-16-13-25(14-17-36)18-24-7-11-28(32)12-8-24/h3-12,15,22-23,25,34H,13-14,16-21H2,1-2H3/t22-,23+
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599721
PNG
(CHEMBL5175905)
Show SMILES C[C@H]1CN(Cc2ccc(cc2)-c2cccnc2N2CCC(CC2)Nc2cccc(F)c2)CCN1 |r|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599722
PNG
(CHEMBL5187975)
Show SMILES C[C@H]1CN(Cc2ccc(NC(=O)[C@H]3CC[C@@H](CC3)Oc3ccc(F)cc3)cc2)CCN1 |r,wU:1.0,12.11,wD:15.18,(-2.66,2.7,;-4,1.93,;-4,.39,;-5.33,-.38,;-5.33,-1.92,;-4,-2.69,;-2.66,-1.92,;-1.33,-2.69,;-1.33,-4.23,;-0,-5,;1.33,-4.23,;2.67,-5,;1.33,-2.69,;-0,-1.92,;-0,-.38,;1.33,.39,;2.67,-.38,;2.67,-1.92,;1.33,1.93,;2.67,2.7,;2.67,4.24,;4,5,;5.33,4.23,;6.66,5,;5.33,2.7,;4.01,1.92,;-2.66,-5,;-4,-4.24,;-6.66,.39,;-6.66,1.93,;-5.33,2.7,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599723
PNG
(CHEMBL5197045)
Show SMILES C[C@H]1CN(Cc2ccc(cc2)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cc2)CCN1 |r,wU:1.0,15.15,wD:18.22,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599724
PNG
(CHEMBL5187776)
Show SMILES C[C@H]1CN(Cc2ccc(N(C)C(=O)[C@H]3CC[C@@H](CC3)Oc3ccc(F)cc3)c(C)c2)CCN1 |r,wU:1.0,13.12,wD:16.19,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-2.66,-4.23,;-2.66,-5.77,;-4,-3.47,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599725
PNG
(CHEMBL5187928)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cc2)CCN1 |r,wU:1.0,16.16,wD:19.23,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-5.33,-4.24,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599726
PNG
(CHEMBL5179543)
Show SMILES C[C@H]1CN(Cc2ccc(cc2Cl)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cc2)CCN1 |r,wU:1.0,16.16,wD:19.23,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-5.33,-4.24,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.67,5.77,;5.33,3.47,;4.01,2.69,;-6.67,1.16,;-6.67,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599727
PNG
(CHEMBL5179463)
Show SMILES CN(C(=O)[C@H]1CC[C@@H](CC1)Oc1ccc(F)cc1)c1ccc(CN2CCNCC2)c(C)c1 |r,wU:4.3,wD:7.10,(-0,-5.77,;-0,-4.23,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-1.33,-3.46,;-1.33,-1.92,;-2.66,-1.15,;-4,-1.92,;-5.33,-1.15,;-5.33,.39,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,;-4,2.7,;-4,1.16,;-4,-3.47,;-5.33,-4.24,;-2.66,-4.23,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599728
PNG
(CHEMBL5179060)
Show SMILES CC[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cc2)CCN1 |r,wU:2.1,17.17,wD:20.24,(-2.66,5.01,;-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-5.33,-4.24,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599729
PNG
(CHEMBL5184722)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cn2)CCN1 |r,wU:16.16,1.0,wD:19.23,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-5.33,-4.24,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.67,5.77,;5.33,3.47,;4.01,2.69,;-6.67,1.16,;-6.67,2.7,;-5.33,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599730
PNG
(CHEMBL5196819)
Show SMILES CC[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccnc(c2)C#N)CCN1 |r,wU:2.1,17.17,wD:20.24,(-3.33,5.01,;-3.33,3.47,;-4.67,2.7,;-4.67,1.16,;-6,.39,;-6,-1.15,;-4.67,-1.92,;-3.33,-1.15,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.15,;-.67,.39,;.66,1.16,;2,.39,;2,-1.15,;.66,2.7,;2,3.47,;2,5.01,;3.33,5.77,;4.66,5,;4.67,3.47,;3.34,2.69,;6,2.7,;7.33,1.93,;-7.33,1.16,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599731
PNG
(CHEMBL5201797)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cccc(CO)c2)CCN1 |r,wU:1.0,16.16,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.16,;-6,.39,;-6,-1.15,;-4.67,-1.92,;-3.33,-1.15,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.15,;-.67,.39,;.66,1.16,;2,.39,;2,-1.15,;.66,2.7,;2,3.47,;2,5.01,;3.33,5.77,;4.66,5,;4.67,3.47,;6,2.7,;7.33,3.47,;3.34,2.69,;-7.33,1.16,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599732
PNG
(CHEMBL5190786)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)c(CO)c2)CCN1 |r,wU:16.16,1.0,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.16,;-6,.39,;-6,-1.15,;-4.67,-1.92,;-3.33,-1.15,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.15,;-.67,.39,;.66,1.16,;2,.39,;2,-1.15,;.66,2.7,;2,3.47,;2,5.01,;3.33,5.77,;4.66,5,;6,5.77,;4.67,3.47,;6,2.7,;7.33,3.47,;3.34,2.69,;-7.33,1.16,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599733
PNG
(CHEMBL5203126)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cc(CO)ccc2C)CCN1 |r,wU:16.16,1.0,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.15,;-6,.38,;-6,-1.16,;-4.67,-1.93,;-3.33,-1.16,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.16,;-.67,.38,;.66,1.15,;2,.38,;2,-1.16,;.66,2.69,;2,3.46,;3.34,2.69,;4.67,3.47,;6,2.7,;7.33,3.47,;4.66,5,;3.33,5.77,;2,5,;.66,5.77,;-7.33,1.15,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599734
PNG
(CHEMBL5179573)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(Cl)c(CO)c2)CCN1 |r,wU:16.16,1.0,wD:19.23,(-3.33,3.47,;-4.67,2.7,;-4.67,1.16,;-6,.39,;-6,-1.15,;-4.67,-1.92,;-3.33,-1.15,;-2,-1.92,;-2,-3.46,;-3.33,-4.23,;-4.67,-3.47,;-6,-4.24,;-.67,-4.23,;-.67,-5.77,;.66,-3.46,;2,-4.23,;.66,-1.92,;-.67,-1.15,;-.67,.39,;.66,1.16,;2,.39,;2,-1.15,;.66,2.7,;2,3.47,;2,5.01,;3.33,5.77,;4.66,5,;6,5.77,;4.67,3.47,;6,2.7,;7.33,3.47,;3.34,2.69,;-7.33,1.16,;-7.33,2.7,;-6,3.47,)|
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599735
PNG
(CHEMBL5192584)
Show SMILES CCOCc1cccc(N[C@H]2CC[C@@H](CC2)C(=O)N(C)c2ccc(CN3CCN[C@@H](C)C3)c(C)c2)c1 |r,wU:13.16,29.30,wD:10.9,(8.67,3.47,;7.33,2.7,;6,3.47,;4.67,2.7,;3.33,3.47,;3.33,5,;2,5.77,;.66,5.01,;.66,3.47,;-.67,2.7,;-.67,1.16,;-2,.39,;-2,-1.15,;-.67,-1.92,;.66,-1.15,;.66,.39,;-.67,-3.46,;.66,-4.23,;-2,-4.23,;-2,-5.77,;-3.34,-3.46,;-3.34,-1.92,;-4.67,-1.15,;-6,-1.92,;-7.33,-1.15,;-7.33,.39,;-8.67,1.16,;-8.67,2.7,;-7.33,3.47,;-6,2.7,;-4.67,3.47,;-6,1.16,;-6,-3.47,;-7.33,-4.24,;-4.66,-4.23,;2,2.69,)|
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Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599736
PNG
(CHEMBL5196982)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cccc(CCO)c2)CCN1 |r,wU:16.16,1.0,wD:19.23,(-4,3.47,;-5.33,2.7,;-5.33,1.16,;-6.67,.39,;-6.67,-1.15,;-5.33,-1.92,;-4,-1.15,;-2.67,-1.92,;-2.67,-3.46,;-3.99,-4.23,;-5.33,-3.47,;-6.67,-4.24,;-1.34,-4.23,;-1.34,-5.77,;-0,-3.46,;1.33,-4.23,;-0,-1.92,;-1.34,-1.15,;-1.34,.39,;-0,1.16,;1.33,.39,;1.33,-1.15,;-0,2.7,;1.33,3.47,;1.33,5.01,;2.66,5.77,;4,5,;4,3.47,;5.33,2.7,;6.67,3.47,;8,2.7,;2.67,2.69,;-8,1.16,;-8,2.7,;-6.67,3.47,)|
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Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599737
PNG
(CHEMBL5171964)
Show SMILES C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2cccc(CC(C)(C)O)c2)CCN1 |r,wU:16.16,1.0,wD:19.23,(-4,3.47,;-5.33,2.7,;-5.33,1.16,;-6.67,.39,;-6.67,-1.15,;-5.33,-1.92,;-4,-1.15,;-2.67,-1.92,;-2.67,-3.46,;-4,-4.23,;-5.33,-3.47,;-6.67,-4.24,;-1.34,-4.23,;-1.34,-5.77,;-0,-3.46,;1.33,-4.23,;-0,-1.92,;-1.34,-1.15,;-1.34,.39,;-0,1.16,;1.33,.39,;1.33,-1.15,;-0,2.7,;1.33,3.47,;1.33,5.01,;2.66,5.77,;4,5,;4,3.47,;5.33,2.7,;6.67,3.47,;7.44,4.81,;5.9,4.81,;8,2.7,;2.67,2.69,;-8,1.16,;-8,2.7,;-6.67,3.47,)|
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Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50599738
PNG
(CHEMBL5192530)
Show SMILES CC(C)NC(=O)Cc1cccc(O[C@H]2CC[C@@H](CC2)C(=O)N(C)c2ccc(CN3CCN[C@@H](C)C3)c(C)c2)c1 |r,wU:16.19,32.33,wD:13.12,(9.33,2.7,;8,3.47,;8,5.01,;6.67,2.7,;5.33,3.47,;5.33,5.01,;4,2.7,;2.67,3.47,;2.66,5,;1.33,5.77,;-0,5.01,;-0,3.47,;-1.34,2.7,;-1.34,1.16,;-2.67,.39,;-2.67,-1.15,;-1.34,-1.92,;-0,-1.15,;-0,.39,;-1.34,-3.46,;-0,-4.23,;-2.67,-4.23,;-2.67,-5.77,;-4,-3.46,;-4,-1.92,;-5.33,-1.15,;-6.67,-1.92,;-8,-1.15,;-8,.39,;-9.33,1.16,;-9.33,2.7,;-8,3.47,;-6.67,2.7,;-5.33,3.47,;-6.67,1.16,;-6.67,-3.47,;-8,-4.24,;-5.33,-4.23,;1.34,2.69,)|
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Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50292978
PNG
(CHEMBL489095 | GSK-962040 | N-(3-Fluorophenyl)-1-[...)
Show SMILES C[C@H]1CN(Cc2ccc(CC(=O)N3CCC(CC3)Nc3cccc(F)c3)cc2)CCN1 |r|
Show InChI InChI=1S/C25H33FN4O/c1-19-17-29(14-11-27-19)18-21-7-5-20(6-8-21)15-25(31)30-12-9-23(10-13-30)28-24-4-2-3-22(26)16-24/h2-8,16,19,23,27-28H,9-15,17-18H2,1H3/t19-/m0/s1
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n/an/an/an/a 970n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128554
BindingDB Entry DOI: 10.7270/Q2Q81J37
More data for this
Ligand-Target Pair