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BDBM50099202 CHEMBL265391::Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg-(CH2-NH)Tyr-NH2

SMILES: CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CN[C@@H](Cc1ccc(O)cc1)C(N)=O

InChI Key: InChIKey=YDHWPDFLAWDXAS-CZZOBQBISA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50099202   
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
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50099202
PNG
(CHEMBL265391 | Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg-(CH...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CN[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C57H93N17O11/c1-7-32(5)46(59)53(83)72-43(29-45(58)77)55(85)74-25-11-14-44(74)52(82)73-47(33(6)8-2)54(84)71-42(28-35-17-21-38(76)22-18-35)51(81)69-39(13-10-24-66-57(63)64)49(79)70-41(26-31(3)4)50(80)68-36(12-9-23-65-56(61)62)30-67-40(48(60)78)27-34-15-19-37(75)20-16-34/h15-22,31-33,36,39-44,46-47,67,75-76H,7-14,23-30,59H2,1-6H3,(H2,58,77)(H2,60,78)(H,68,80)(H,69,81)(H,70,79)(H,71,84)(H,72,83)(H,73,82)(H4,61,62,65)(H4,63,64,66)/t32-,33-,36-,39-,40-,41-,42-,43-,44-,46-,47-/m0/s1
PDB

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UniProtKB/SwissProt

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PubMed
34.8n/an/an/an/an/an/an/an/a



University of Cincinnati and VA Medical Centers

Curated by ChEMBL


Assay Description
Affinity for cloned Y1 receptor using [125I]-PYY as radioligand


J Med Chem 44: 1479-82 (2001)


BindingDB Entry DOI: 10.7270/Q2RJ4HRJ
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50099202
PNG
(CHEMBL265391 | Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg-(CH...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CN[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C57H93N17O11/c1-7-32(5)46(59)53(83)72-43(29-45(58)77)55(85)74-25-11-14-44(74)52(82)73-47(33(6)8-2)54(84)71-42(28-35-17-21-38(76)22-18-35)51(81)69-39(13-10-24-66-57(63)64)49(79)70-41(26-31(3)4)50(80)68-36(12-9-23-65-56(61)62)30-67-40(48(60)78)27-34-15-19-37(75)20-16-34/h15-22,31-33,36,39-44,46-47,67,75-76H,7-14,23-30,59H2,1-6H3,(H2,58,77)(H2,60,78)(H,68,80)(H,69,81)(H,70,79)(H,71,84)(H,72,83)(H,73,82)(H4,61,62,65)(H4,63,64,66)/t32-,33-,36-,39-,40-,41-,42-,43-,44-,46-,47-/m0/s1
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PubMed
1.65E+3n/an/an/an/an/an/an/an/a



University of Cincinnati and VA Medical Centers

Curated by ChEMBL


Assay Description
Affinity for cloned Y2 receptor using [125I]-PYY as radioligand


J Med Chem 44: 1479-82 (2001)


BindingDB Entry DOI: 10.7270/Q2RJ4HRJ
More data for this
Ligand-Target Pair
PPYR1


(Homo sapiens (Human))
BDBM50099202
PNG
(CHEMBL265391 | Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg-(CH...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CN[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C57H93N17O11/c1-7-32(5)46(59)53(83)72-43(29-45(58)77)55(85)74-25-11-14-44(74)52(82)73-47(33(6)8-2)54(84)71-42(28-35-17-21-38(76)22-18-35)51(81)69-39(13-10-24-66-57(63)64)49(79)70-41(26-31(3)4)50(80)68-36(12-9-23-65-56(61)62)30-67-40(48(60)78)27-34-15-19-37(75)20-16-34/h15-22,31-33,36,39-44,46-47,67,75-76H,7-14,23-30,59H2,1-6H3,(H2,58,77)(H2,60,78)(H,68,80)(H,69,81)(H,70,79)(H,71,84)(H,72,83)(H,73,82)(H4,61,62,65)(H4,63,64,66)/t32-,33-,36-,39-,40-,41-,42-,43-,44-,46-,47-/m0/s1
Reactome pathway
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UniProtKB/SwissProt

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PC sid
UniChem

Similars

PubMed
3.74E+3n/an/an/an/an/an/an/an/a



University of Cincinnati and VA Medical Centers

Curated by ChEMBL


Assay Description
Affinity for cloned Y4 receptor using [125I]-PP as radioligand


J Med Chem 44: 1479-82 (2001)


BindingDB Entry DOI: 10.7270/Q2RJ4HRJ
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 5 ( NPY Y5)


(Homo sapiens (Human))
BDBM50099202
PNG
(CHEMBL265391 | Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg-(CH...)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CN[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C57H93N17O11/c1-7-32(5)46(59)53(83)72-43(29-45(58)77)55(85)74-25-11-14-44(74)52(82)73-47(33(6)8-2)54(84)71-42(28-35-17-21-38(76)22-18-35)51(81)69-39(13-10-24-66-57(63)64)49(79)70-41(26-31(3)4)50(80)68-36(12-9-23-65-56(61)62)30-67-40(48(60)78)27-34-15-19-37(75)20-16-34/h15-22,31-33,36,39-44,46-47,67,75-76H,7-14,23-30,59H2,1-6H3,(H2,58,77)(H2,60,78)(H,68,80)(H,69,81)(H,70,79)(H,71,84)(H,72,83)(H,73,82)(H4,61,62,65)(H4,63,64,66)/t32-,33-,36-,39-,40-,41-,42-,43-,44-,46-,47-/m0/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
5.08E+3n/an/an/an/an/an/an/an/a



University of Cincinnati and VA Medical Centers

Curated by ChEMBL


Assay Description
Affinity for cloned Y5 receptor using [125I]-PYY as radioligand


J Med Chem 44: 1479-82 (2001)


BindingDB Entry DOI: 10.7270/Q2RJ4HRJ
More data for this
Ligand-Target Pair