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BDBM85501 DPhe6-Bn(6-13)hydrazide

SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)NN

InChI Key: InChIKey=MEDVDTBZNUFBBB-VCKQZXTJSA-N

Data: 4 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 4 hits for monomerid = 85501   
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
Gastrin-Releasing peptide


(RAT)
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
KEGG

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.20E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
Bombesin 4


(Frog)
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.24E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
NMB


(RAT)
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
Reactome pathway
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair
BRS3


(Homo sapiens (Human))
BDBM85501
PNG
(DPhe6-Bn(6-13)hydrazide)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)Cc1ccccc1)C(C)C)C(=O)NN
Show InChI InChI=1S/C47H66N14O9/c1-25(2)17-35(46(69)61-50)58-45(68)37(20-30-22-51-24-54-30)56-39(63)23-53-47(70)40(26(3)4)60-41(64)27(5)55-44(67)36(19-29-21-52-33-14-10-9-13-31(29)33)59-43(66)34(15-16-38(49)62)57-42(65)32(48)18-28-11-7-6-8-12-28/h6-14,21-22,24-27,32,34-37,40,52H,15-20,23,48,50H2,1-5H3,(H2,49,62)(H,51,54)(H,53,70)(H,55,67)(H,56,63)(H,57,65)(H,58,68)(H,59,66)(H,60,64)(H,61,69)/t27-,32+,34-,35-,36-,37-,40-/m0/s1
Reactome pathway
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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by PDSP Ki Database




Biochemistry 38: 7307-20 (1999)


Article DOI: 10.1021/bi990204w
BindingDB Entry DOI: 10.7270/Q29022BG
More data for this
Ligand-Target Pair