BDBM50339194 CHEMBL1689456

SMILES: CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccccc2)NC(C)=O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(C)C)C(N)=O

InChI Key: InChIKey=NUAVLYAMYMIYMQ-XLUOEVAHSA-N

Data: 1 IC50  1 Kd

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 2 hits for monomerid = 50339194   

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
Placenta growth factor (Homo sapiens (Human))	BDBM50339194 (CHEMBL1689456) Show SMILES CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccccc2)NC(C)=O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(C)C)C(N)=O |r| Show InChI InChI=1S/C85H129N21O19S3/c1-44(2)34-62-85(125)106-32-21-28-65(106)80(120)98-60(37-52-40-89-43-91-52)75(115)100-63(78(118)95-57(27-18-20-31-87)73(113)102-67(45(3)4)81(121)93-55(71(88)111)29-33-126-11)41-127-128-42-64(101-82(122)68(46(5)6)103-77(117)61(38-66(109)110)97-74(114)58(92-49(10)108)35-50-22-13-12-14-23-50)79(119)94-56(26-17-19-30-86)72(112)96-59(36-51-39-90-54-25-16-15-24-53(51)54)76(116)104-69(47(7)8)83(123)105-70(48(9)107)84(124)99-62/h12-16,22-25,39-40,43-48,55-65,67-70,90,107H,17-21,26-38,41-42,86-87H2,1-11H3,(H2,88,111)(H,89,91)(H,92,108)(H,93,121)(H,94,119)(H,95,118)(H,96,112)(H,97,114)(H,98,120)(H,99,124)(H,100,115)(H,101,122)(H,102,113)(H,103,117)(H,104,116)(H,105,123)(H,109,110)/t48-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,67+,68+,69+,70+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human PlGF-1-VEGFR-1 interaction by ELISA				J Med Chem 54: 1256-65 (2011) Article DOI: 10.1021/jm101226k BindingDB Entry DOI: 10.7270/Q2BK1CN1
					More data for this Ligand-Target Pair
Placenta growth factor (Homo sapiens (Human))	BDBM50339194 (CHEMBL1689456) Show SMILES CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc2ccccc2)NC(C)=O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(C)C)C(N)=O |r| Show InChI InChI=1S/C85H129N21O19S3/c1-44(2)34-62-85(125)106-32-21-28-65(106)80(120)98-60(37-52-40-89-43-91-52)75(115)100-63(78(118)95-57(27-18-20-31-87)73(113)102-67(45(3)4)81(121)93-55(71(88)111)29-33-126-11)41-127-128-42-64(101-82(122)68(46(5)6)103-77(117)61(38-66(109)110)97-74(114)58(92-49(10)108)35-50-22-13-12-14-23-50)79(119)94-56(26-17-19-30-86)72(112)96-59(36-51-39-90-54-25-16-15-24-53(51)54)76(116)104-69(47(7)8)83(123)105-70(48(9)107)84(124)99-62/h12-16,22-25,39-40,43-48,55-65,67-70,90,107H,17-21,26-38,41-42,86-87H2,1-11H3,(H2,88,111)(H,89,91)(H,92,108)(H,93,121)(H,94,119)(H,95,118)(H,96,112)(H,97,114)(H,98,120)(H,99,124)(H,100,115)(H,101,122)(H,102,113)(H,103,117)(H,104,116)(H,105,123)(H,109,110)/t48-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,67+,68+,69+,70+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to human PlGF-1				J Med Chem 54: 1256-65 (2011) Article DOI: 10.1021/jm101226k BindingDB Entry DOI: 10.7270/Q2BK1CN1
					More data for this Ligand-Target Pair