BDBM50031489 CHEMBL3352878

SMILES: CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O

InChI Key: InChIKey=FAONKRMCZFSASU-PCYFNTAWSA-N

Data: 4 EC50

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 = 50031489   

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
Melanocortin receptor 5 (MC5R) (Mus musculus (Mouse))	BDBM50031489 (CHEMBL3352878) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O |r| Show InChI InChI=1S/C50H71N17O8/c1-4-6-17-37(60-30(3)68)44(70)62-38(18-7-5-2)45(71)66-42(26-33-28-55-29-58-33)49(75)64-40(24-31-14-9-8-10-15-31)47(73)63-39(20-13-22-56-50(52)53)46(72)65-41(25-32-27-57-35-19-12-11-16-34(32)35)48(74)61-36(43(51)69)21-23-59-67-54/h8-12,14-16,19,27-29,36-42,57H,4-7,13,17-18,20-26H2,1-3H3,(H2,51,69)(H,55,58)(H,60,68)(H,61,74)(H,62,70)(H,63,73)(H,64,75)(H,65,72)(H,66,71)(H4,52,53,56)/t36-,37-,38-,39-,40+,41-,42-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.230	n/a	n/a	n/a	n/a
University of Cergy-Pontoise Curated by ChEMBL					Assay Description Activity at mouse MC5R expressed in HEK293 cells assessed as cAMP accumulation by CRE/beta-galactosidase reporter gene assay				J Med Chem 57: 9424-34 (2014) Article DOI: 10.1021/jm501027w BindingDB Entry DOI: 10.7270/Q21G0NVT
					More data for this Ligand-Target Pair
Melanocortin receptor 1 (Mus musculus)	BDBM50031489 (CHEMBL3352878) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O |r| Show InChI InChI=1S/C50H71N17O8/c1-4-6-17-37(60-30(3)68)44(70)62-38(18-7-5-2)45(71)66-42(26-33-28-55-29-58-33)49(75)64-40(24-31-14-9-8-10-15-31)47(73)63-39(20-13-22-56-50(52)53)46(72)65-41(25-32-27-57-35-19-12-11-16-34(32)35)48(74)61-36(43(51)69)21-23-59-67-54/h8-12,14-16,19,27-29,36-42,57H,4-7,13,17-18,20-26H2,1-3H3,(H2,51,69)(H,55,58)(H,60,68)(H,61,74)(H,62,70)(H,63,73)(H,64,75)(H,65,72)(H,66,71)(H4,52,53,56)/t36-,37-,38-,39-,40+,41-,42-/m0/s1	KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
University of Cergy-Pontoise Curated by ChEMBL					Assay Description Activity at mouse MC1R expressed in HEK293 cells assessed as cAMP accumulation by CRE/beta-galactosidase reporter gene assay				J Med Chem 57: 9424-34 (2014) Article DOI: 10.1021/jm501027w BindingDB Entry DOI: 10.7270/Q21G0NVT
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Mus musculus)	BDBM50031489 (CHEMBL3352878) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O |r| Show InChI InChI=1S/C50H71N17O8/c1-4-6-17-37(60-30(3)68)44(70)62-38(18-7-5-2)45(71)66-42(26-33-28-55-29-58-33)49(75)64-40(24-31-14-9-8-10-15-31)47(73)63-39(20-13-22-56-50(52)53)46(72)65-41(25-32-27-57-35-19-12-11-16-34(32)35)48(74)61-36(43(51)69)21-23-59-67-54/h8-12,14-16,19,27-29,36-42,57H,4-7,13,17-18,20-26H2,1-3H3,(H2,51,69)(H,55,58)(H,60,68)(H,61,74)(H,62,70)(H,63,73)(H,64,75)(H,65,72)(H,66,71)(H4,52,53,56)/t36-,37-,38-,39-,40+,41-,42-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a
University of Cergy-Pontoise Curated by ChEMBL					Assay Description Activity at mouse MC3R expressed in HEK293 cells assessed as cAMP accumulation by CRE/beta-galactosidase reporter gene assay				J Med Chem 57: 9424-34 (2014) Article DOI: 10.1021/jm501027w BindingDB Entry DOI: 10.7270/Q21G0NVT
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Mus musculus)	BDBM50031489 (CHEMBL3352878) Show SMILES CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCN=[N+]=[N-])C(N)=O |r| Show InChI InChI=1S/C50H71N17O8/c1-4-6-17-37(60-30(3)68)44(70)62-38(18-7-5-2)45(71)66-42(26-33-28-55-29-58-33)49(75)64-40(24-31-14-9-8-10-15-31)47(73)63-39(20-13-22-56-50(52)53)46(72)65-41(25-32-27-57-35-19-12-11-16-34(32)35)48(74)61-36(43(51)69)21-23-59-67-54/h8-12,14-16,19,27-29,36-42,57H,4-7,13,17-18,20-26H2,1-3H3,(H2,51,69)(H,55,58)(H,60,68)(H,61,74)(H,62,70)(H,63,73)(H,64,75)(H,65,72)(H,66,71)(H4,52,53,56)/t36-,37-,38-,39-,40+,41-,42-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.290	n/a	n/a	n/a	n/a
University of Cergy-Pontoise Curated by ChEMBL					Assay Description Activity at mouse MC4R expressed in HEK293 cells assessed as cAMP accumulation by CRE/beta-galactosidase reporter gene assay				J Med Chem 57: 9424-34 (2014) Article DOI: 10.1021/jm501027w BindingDB Entry DOI: 10.7270/Q21G0NVT
					More data for this Ligand-Target Pair