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BDBM85996 [leu13]pMOT(1-9)

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(N)=O

InChI Key: InChIKey=IXTJVNGUMKEPQQ-XVXTWCDZSA-N

Data: 1 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 85996   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Motilin


(Homo sapiens (Human))
BDBM85996
PNG
([leu13]pMOT(1-9))
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(N)=O |r|
Show InChI InChI=1S/C54H74N10O13/c1-6-31(4)45(62-51(74)41-18-13-25-64(41)54(77)44(30(2)3)61-48(71)37(55)26-33-14-9-7-10-15-33)52(75)60-40(27-34-16-11-8-12-17-34)50(73)63-46(32(5)65)53(76)59-39(28-35-19-21-36(66)22-20-35)49(72)57-29-42(67)58-38(47(56)70)23-24-43(68)69/h7-12,14-17,19-22,30-32,37-41,44-46,65-66H,6,13,18,23-29,55H2,1-5H3,(H2,56,70)(H,57,72)(H,58,67)(H,59,76)(H,60,75)(H,61,71)(H,62,74)(H,63,73)(H,68,69)/t31-,32+,37-,38-,39-,40-,41-,44-,45-,46-/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
4.07E+3n/an/an/an/an/an/an/an/a



Katholieke Universiteit Leuven

Curated by PDSP Ki Database




Biochem Biophys Res Commun 293: 1223-7 (2002)


Article DOI: 10.1016/S0006-291X(02)00356-X
BindingDB Entry DOI: 10.7270/Q2KP80RP
More data for this
Ligand-Target Pair