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BDBM85733 H-Dmt-D-Arg-Phe-A2bu-NH2

SMILES: [#6]-c1cc(-[#8])cc(-[#6])c1-[#6]-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#7])-[#6](-[#7])=O

InChI Key: InChIKey=PDGOKQOUTUDKQQ-JBXUNAHCSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 85733   
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
Mu-type opioid receptor


(GUINEA PIG)
BDBM85733
PNG
(H-Dmt-D-Arg-Phe-A2bu-NH2)
Show SMILES [#6]-c1cc(-[#8])cc(-[#6])c1-[#6]-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#7])-[#6](-[#7])=O
Show InChI InChI=1S/C30H45N9O5/c1-17-13-20(40)14-18(2)21(17)16-22(32)27(42)38-24(9-6-12-36-30(34)35)28(43)39-25(15-19-7-4-3-5-8-19)29(44)37-23(10-11-31)26(33)41/h3-5,7-8,13-14,22-25,40H,6,9-12,15-16,31-32H2,1-2H3,(H2,33,41)(H,37,44)(H,38,42)(H,39,43)(H4,34,35,36)/t22-,23-,24+,25-/m0/s1
UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.803n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by PDSP Ki Database




Eur J Med Chem 35: 895-901 (2000)


Article DOI: 10.1016/s0223-5234(00)01171-5
BindingDB Entry DOI: 10.7270/Q23X856N
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM85733
PNG
(H-Dmt-D-Arg-Phe-A2bu-NH2)
Show SMILES [#6]-c1cc(-[#8])cc(-[#6])c1-[#6]-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#7])-[#6](-[#7])=O
Show InChI InChI=1S/C30H45N9O5/c1-17-13-20(40)14-18(2)21(17)16-22(32)27(42)38-24(9-6-12-36-30(34)35)28(43)39-25(15-19-7-4-3-5-8-19)29(44)37-23(10-11-31)26(33)41/h3-5,7-8,13-14,22-25,40H,6,9-12,15-16,31-32H2,1-2H3,(H2,33,41)(H,37,44)(H,38,42)(H,39,43)(H4,34,35,36)/t22-,23-,24+,25-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
47.5n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by PDSP Ki Database




Eur J Med Chem 35: 895-901 (2000)


Article DOI: 10.1016/s0223-5234(00)01171-5
BindingDB Entry DOI: 10.7270/Q23X856N
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM85733
PNG
(H-Dmt-D-Arg-Phe-A2bu-NH2)
Show SMILES [#6]-c1cc(-[#8])cc(-[#6])c1-[#6]-[#6@H](-[#7])-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#7])-[#6](-[#7])=O
Show InChI InChI=1S/C30H45N9O5/c1-17-13-20(40)14-18(2)21(17)16-22(32)27(42)38-24(9-6-12-36-30(34)35)28(43)39-25(15-19-7-4-3-5-8-19)29(44)37-23(10-11-31)26(33)41/h3-5,7-8,13-14,22-25,40H,6,9-12,15-16,31-32H2,1-2H3,(H2,33,41)(H,37,44)(H,38,42)(H,39,43)(H4,34,35,36)/t22-,23-,24+,25-/m0/s1
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.13E+3n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by PDSP Ki Database




Eur J Med Chem 35: 895-901 (2000)


Article DOI: 10.1016/s0223-5234(00)01171-5
BindingDB Entry DOI: 10.7270/Q23X856N
More data for this
Ligand-Target Pair