BDBM85947 Gva6,Ava14,15::Gva6,betaAla14,15

SMILES: [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7]

InChI Key: InChIKey=PFOLUDDPZLREOE-UHFFFAOYSA-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 = 85947   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM85947 (Gva6,Ava14,15 | Gva6,betaAla14,15) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C50H84N16O11S3/c1-28(2)23-34-44(73)59-25-40(70)60-32(11-10-21-58-50(54)55)46(75)66-41(29(3)4)48(77)65-35(24-30-14-16-31(67)17-15-30)43(72)56-19-8-6-12-38(68)61-36(42(51)71)26-79-80-27-37(62-39(69)13-7-9-20-57-49(52)53)47(76)63-33(18-22-78-5)45(74)64-34/h14-17,28-29,32-37,41,67H,6-13,18-27H2,1-5H3,(H2,51,71)(H,56,72)(H,59,73)(H,60,70)(H,61,68)(H,62,69)(H,63,76)(H,64,74)(H,65,77)(H,66,75)(H4,52,53,57)(H4,54,55,58)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by PDSP Ki Database									Biochemistry 41: 6383-90 (2002) Article DOI: 10.1021/bi0200514 BindingDB Entry DOI: 10.7270/Q23N21ZT
					More data for this Ligand-Target Pair
GPR145 (Homo sapiens (Human))	BDBM85947 (Gva6,Ava14,15 | Gva6,betaAla14,15) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C50H84N16O11S3/c1-28(2)23-34-44(73)59-25-40(70)60-32(11-10-21-58-50(54)55)46(75)66-41(29(3)4)48(77)65-35(24-30-14-16-31(67)17-15-30)43(72)56-19-8-6-12-38(68)61-36(42(51)71)26-79-80-27-37(62-39(69)13-7-9-20-57-49(52)53)47(76)63-33(18-22-78-5)45(74)64-34/h14-17,28-29,32-37,41,67H,6-13,18-27H2,1-5H3,(H2,51,71)(H,56,72)(H,59,73)(H,60,70)(H,61,68)(H,62,69)(H,63,76)(H,64,74)(H,65,77)(H,66,75)(H4,52,53,57)(H4,54,55,58)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by PDSP Ki Database									Biochemistry 41: 6383-90 (2002) Article DOI: 10.1021/bi0200514 BindingDB Entry DOI: 10.7270/Q23N21ZT
					More data for this Ligand-Target Pair
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM85947 (Gva6,Ava14,15 | Gva6,betaAla14,15) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C50H84N16O11S3/c1-28(2)23-34-44(73)59-25-40(70)60-32(11-10-21-58-50(54)55)46(75)66-41(29(3)4)48(77)65-35(24-30-14-16-31(67)17-15-30)43(72)56-19-8-6-12-38(68)61-36(42(51)71)26-79-80-27-37(62-39(69)13-7-9-20-57-49(52)53)47(76)63-33(18-22-78-5)45(74)64-34/h14-17,28-29,32-37,41,67H,6-13,18-27H2,1-5H3,(H2,51,71)(H,56,72)(H,59,73)(H,60,70)(H,61,68)(H,62,69)(H,63,76)(H,64,74)(H,65,77)(H,66,75)(H4,52,53,57)(H4,54,55,58)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by PDSP Ki Database									Biochemistry 41: 6383-90 (2002) Article DOI: 10.1021/bi0200514 BindingDB Entry DOI: 10.7270/Q23N21ZT
					More data for this Ligand-Target Pair
GPR145 (Homo sapiens (Human))	BDBM85947 (Gva6,Ava14,15 | Gva6,betaAla14,15) Show SMILES [#6]-[#16]-[#6]-[#6]-[#6]-1-[#7]-[#6](=O)-[#6](-[#6]-[#16]-[#16]-[#6]-[#6](-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6](=O)-[#6](-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6]-1=O)-[#6](-[#6])-[#6])-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7] Show InChI InChI=1S/C50H84N16O11S3/c1-28(2)23-34-44(73)59-25-40(70)60-32(11-10-21-58-50(54)55)46(75)66-41(29(3)4)48(77)65-35(24-30-14-16-31(67)17-15-30)43(72)56-19-8-6-12-38(68)61-36(42(51)71)26-79-80-27-37(62-39(69)13-7-9-20-57-49(52)53)47(76)63-33(18-22-78-5)45(74)64-34/h14-17,28-29,32-37,41,67H,6-13,18-27H2,1-5H3,(H2,51,71)(H,56,72)(H,59,73)(H,60,70)(H,61,68)(H,62,69)(H,63,76)(H,64,74)(H,65,77)(H,66,75)(H4,52,53,57)(H4,54,55,58)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	64	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by PDSP Ki Database									Biochemistry 41: 6383-90 (2002) Article DOI: 10.1021/bi0200514 BindingDB Entry DOI: 10.7270/Q23N21ZT
					More data for this Ligand-Target Pair