Found 2 hits Enz. Inhib. hit(s) with Target = 'Neuropeptide Y receptor type 2' and Ligand = 'BDBM50091658' 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 |
|---|
Neuropeptide Y receptor type 2
(Homo sapiens (Human)) | BDBM50091658
(CHEMBL427594 | N-alpha-Ac-[Tyr22,Phe27]PYY(22-36)-...)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C92H143N29O22/c1-46(2)35-63(115-87(141)70(44-122)119-82(136)66(107-51(10)124)40-54-24-28-57(126)29-25-54)80(134)109-59(20-15-33-104-91(98)99)78(132)117-68(41-55-43-102-45-106-55)84(138)116-67(39-52-17-12-11-13-18-52)83(137)113-64(36-47(3)4)81(135)118-69(42-72(94)128)85(139)114-65(37-48(5)6)86(140)120-73(49(7)8)88(142)121-74(50(9)123)89(143)111-60(21-16-34-105-92(100)101)76(130)110-61(30-31-71(93)127)79(133)108-58(19-14-32-103-90(96)97)77(131)112-62(75(95)129)38-53-22-26-56(125)27-23-53/h11-13,17-18,22-29,43,45-50,58-70,73-74,122-123,125-126H,14-16,19-21,30-42,44H2,1-10H3,(H2,93,127)(H2,94,128)(H2,95,129)(H,102,106)(H,107,124)(H,108,133)(H,109,134)(H,110,130)(H,111,143)(H,112,131)(H,113,137)(H,114,139)(H,115,141)(H,116,138)(H,117,132)(H,118,135)(H,119,136)(H,120,140)(H,121,142)(H4,96,97,103)(H4,98,99,104)(H4,100,101,105)/t50-,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,73+,74+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.68 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Cincinnati Medical Center
Curated by ChEMBL
| Assay Description
Affinity against Neuropeptide Y receptor Y2 in SK-N-BE2 cell line |
J Med Chem 43: 3420-7 (2000)
BindingDB Entry DOI: 10.7270/Q2QR4WCX |
More data for this
Ligand-Target Pair | |
Neuropeptide Y receptor type 2
(RAT) | BDBM50091658
(CHEMBL427594 | N-alpha-Ac-[Tyr22,Phe27]PYY(22-36)-...)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C92H143N29O22/c1-46(2)35-63(115-87(141)70(44-122)119-82(136)66(107-51(10)124)40-54-24-28-57(126)29-25-54)80(134)109-59(20-15-33-104-91(98)99)78(132)117-68(41-55-43-102-45-106-55)84(138)116-67(39-52-17-12-11-13-18-52)83(137)113-64(36-47(3)4)81(135)118-69(42-72(94)128)85(139)114-65(37-48(5)6)86(140)120-73(49(7)8)88(142)121-74(50(9)123)89(143)111-60(21-16-34-105-92(100)101)76(130)110-61(30-31-71(93)127)79(133)108-58(19-14-32-103-90(96)97)77(131)112-62(75(95)129)38-53-22-26-56(125)27-23-53/h11-13,17-18,22-29,43,45-50,58-70,73-74,122-123,125-126H,14-16,19-21,30-42,44H2,1-10H3,(H2,93,127)(H2,94,128)(H2,95,129)(H,102,106)(H,107,124)(H,108,133)(H,109,134)(H,110,130)(H,111,143)(H,112,131)(H,113,137)(H,114,139)(H,115,141)(H,116,138)(H,117,132)(H,118,135)(H,119,136)(H,120,140)(H,121,142)(H4,96,97,103)(H4,98,99,104)(H4,100,101,105)/t50-,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,73+,74+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/TrEMBL
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Cincinnati Medical Center
Curated by ChEMBL
| Assay Description
Antisecretory potency, affinity for intestinal PYY of rat jejunum by using short circuit current (SCC) method. |
J Med Chem 43: 3420-7 (2000)
BindingDB Entry DOI: 10.7270/Q2QR4WCX |
More data for this
Ligand-Target Pair | |
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