BDBM50339222 CHEMBL1689448

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC1=O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(N)=O

InChI Key: InChIKey=MKVIIOWGWMLXTF-MLJBONJBSA-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 = 50339222   

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))	BDBM50339222 (CHEMBL1689448) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCCN)NC1=O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(N)=O |r| Show InChI InChI=1S/C85H133N23O20S2/c1-11-46(7)68-82(126)98-57(21-17-33-92-85(89)90)74(118)102-62(35-44(3)4)84(128)108-34-18-22-65(108)81(125)101-60(38-52-40-91-43-93-52)76(120)103-63(79(123)96-55(19-13-15-31-86)72(116)94-48(9)71(115)105-67(45(5)6)70(88)114)41-129-130-42-64(80(124)97-56(20-14-16-32-87)73(117)99-59(77(121)106-68)37-51-25-29-54(111)30-26-51)104-83(127)69(47(8)12-2)107-78(122)61(39-66(112)113)100-75(119)58(95-49(10)109)36-50-23-27-53(110)28-24-50/h23-30,40,43-48,55-65,67-69,110-111H,11-22,31-39,41-42,86-87H2,1-10H3,(H2,88,114)(H,91,93)(H,94,116)(H,95,109)(H,96,123)(H,97,124)(H,98,126)(H,99,117)(H,100,119)(H,101,125)(H,102,118)(H,103,120)(H,104,127)(H,105,115)(H,106,121)(H,107,122)(H,112,113)(H4,89,90,92)/t46-,47-,48-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,67-,68-,69-/m0/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	9.00E+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
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