BDBM50339223 (S)-2-((S)-2-((S)-1-((3S,6R,11R,14S,17S,20S,23S,26S,31aS)-3-((1H-indol-3-yl)methyl)-11-((S)-2-((S)-2-((S)-2-acetamido-3-phenylpropanamido)-4-(methylthio)butanamido)-3-methylbutanamido)-14-(2-amino-2-oxoethyl)-17-(4-hydroxybenzyl)-23-((R)-1-hydroxyethyl)-26-isobutyl-20-isopropyl-1,4,12,15,18,21,24,27-octaoxooctacosahydro-1H-pyrrolo[2,1-j][1,2,5,8,11,14,17,20,23,26]dithiaoctaazacyclononacosine-6-carbonyl)pyrrolidine-2-carboxamido)-4-(methylthio)butanamido)pentanediamide::CHEMBL1689449

SMILES: CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(N)=O

InChI Key: InChIKey=JKSNIUWDWKYYEB-PDPJFOOUSA-N

Data: 1 IC50

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 1 hit for monomerid = 50339223   

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))	BDBM50339223 ((S)-2-((S)-2-((S)-1-((3S,6R,11R,14S,17S,20S,23S,26...) Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CC(N)=O)NC1=O)C(C)C)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(N)=O |r| Show InChI InChI=1S/C86H123N19O20S4/c1-44(2)36-62-85(124)104-32-16-23-66(104)81(120)97-60(39-51-41-90-54-21-15-14-20-53(51)54)76(115)100-64(86(125)105-33-17-22-65(105)80(119)94-56(30-34-126-9)73(112)92-55(72(89)111)28-29-67(87)109)43-129-128-42-63(99-82(121)69(45(3)4)101-74(113)57(31-35-127-10)93-75(114)58(91-48(8)107)37-49-18-12-11-13-19-49)79(118)96-61(40-68(88)110)77(116)95-59(38-50-24-26-52(108)27-25-50)78(117)102-70(46(5)6)83(122)103-71(47(7)106)84(123)98-62/h11-15,18-21,24-27,41,44-47,55-66,69-71,90,106,108H,16-17,22-23,28-40,42-43H2,1-10H3,(H2,87,109)(H2,88,110)(H2,89,111)(H,91,107)(H,92,112)(H,93,114)(H,94,119)(H,95,116)(H,96,118)(H,97,120)(H,98,123)(H,99,121)(H,100,115)(H,101,113)(H,102,117)(H,103,122)/t47-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,69+,70+,71+/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	1.90E+4	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