Reaction Details Report a problem with these data
Target
Placenta growth factor
Ligand
BDBM50339226
Substrate
n/a
Meas. Tech.
ChEMBL_736105 (CHEMBL1692888)
IC50
5000±n/a nM
Citation
 Bower, KE; Lam, SN; Oates, BD; Del Rosario, JR; Corner, E; Osothprarop, TF; Kinhikar, AG; Hoye, JA; Preston, RR; Murphy, RE; Campbell, LA; Huang, H; Jimenez, J; Cao, X; Chen, G; Ainekulu, ZW; Datt, AB; Levin, NJ; Doppalapudi, VR; Pirie-Shepherd, SR; Bradshaw, C; Woodnutt, G; Lappe, RW Evolution of potent and stable placental-growth-factor-1-targeting CovX-bodies from phage display peptide discovery. J Med Chem 54:1256-65 (2011) [PubMed]  Article 
Target
Name:
Placenta growth factor
Synonyms:
PGF | PGFL | PLGF | PLGF_HUMAN
Type:
PROTEIN
Mol. Mass.:
24794.98
Organism:
Homo sapiens (Human)
Description:
ChEMBL_942634
Residue:
221
Sequence:
MPVMRLFPCFLQLLAGLALPAVPPQQWALSAGNGSSEVEVVPFQEVWGRSYCRALERLVDVVSEYPSEVEHMFSPSCVSLLRCTGCCGDENLHCVPVETANVTMQLLKIRSGDRPSYVELTFSQHVRCECRHSPGRQSPDMPGDFRADAPSFLPPRRSLPMLFRMEWGCALTGSQSAVWPSSPVPEEIPRMHPGRNGKKQQRKPLREKMKPERCGDAVPRR
  
Inhibitor
Name:
BDBM50339226
Synonyms:
(S)-4-((S)-1-((4R,7S,10S,13S,19S,22S,25S,28R)-7-((1H-imidazol-5-yl)methyl)-22-((1H-indol-3-yl)methyl)-25-(2-amino-2-oxoethyl)-4-((5S,8S,11S)-16-amino-5-carbamoyl-16-imino-8-isopropyl-7,10-dioxo-2-thia-6,9,15-triazahexadecan-11-ylcarbamoyl)-13-isobutyl-19-isopropyl-10-methyl-6,9,12,15,18,21,24,27-octaoxo-1,2-dithia-5,8,11,14,17,20,23,26-octaazacyclononacosan-28-ylamino)-3-methyl-1-oxobutan-2-ylamino)-3-((S)-2-acetamido-3-phenylpropanamido)-4-oxobutanoic acid | CHEMBL1689452
Type:
Small organic molecule
Emp. Form.:
C79H117N23O19S3
Mol. Mass.:
1789.112
SMILES:
CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)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](CC(N)=O)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N1)C(C)C)C(N)=O |r,wU:62.63,70.71,108.111,84.87,4.4,12.19,32.32,44.52,103.106,wD:28.28,95.98,8.8,36.40,23.22,(-4.06,-50.99,;-2.73,-50.21,;-2.73,-48.67,;-1.39,-47.9,;-1.39,-46.37,;-.05,-45.59,;1.28,-46.37,;1.28,-47.9,;2.61,-45.59,;3.96,-46.37,;5.29,-45.59,;5.29,-44.05,;6.62,-46.37,;6.62,-47.9,;5.29,-48.67,;5.29,-50.21,;3.96,-50.99,;3.96,-52.53,;5.29,-53.3,;2.61,-53.3,;7.95,-45.6,;9.28,-46.37,;9.28,-47.9,;10.61,-45.59,;10.61,-44.06,;9.29,-43.24,;9.31,-41.67,;7.97,-40.87,;7.98,-39.32,;6.66,-38.55,;5.31,-39.29,;5.31,-40.84,;3.97,-38.54,;2.64,-39.31,;1.32,-38.56,;1.32,-37.02,;-.03,-39.33,;-.01,-40.86,;-1.35,-41.66,;-2.71,-40.89,;-1.33,-43.21,;-1.34,-38.57,;-1.33,-37.01,;.02,-36.24,;-2.67,-36.22,;-2.66,-34.67,;-1.31,-33.9,;.03,-34.69,;1.38,-33.92,;1.39,-32.36,;.04,-31.57,;-1.31,-32.35,;-4.02,-36.99,;-5.37,-36.21,;-6.72,-36.98,;-5.36,-34.65,;3.98,-37.01,;5.29,-36.24,;2.63,-36.24,;9.35,-38.55,;10.68,-39.3,;9.29,-37.07,;10.62,-36.3,;10.64,-34.76,;9.29,-33.98,;7.94,-34.74,;9.3,-32.43,;11.96,-37.08,;11.95,-38.62,;13.29,-36.33,;14.62,-37.12,;15.94,-36.37,;15.96,-34.83,;17.22,-33.96,;16.77,-32.49,;15.23,-32.47,;14.22,-31.32,;12.72,-31.62,;12.23,-33.08,;13.24,-34.23,;14.74,-33.93,;14.6,-38.65,;13.26,-39.41,;15.93,-39.43,;19.87,-37.17,;21.2,-36.39,;21.2,-34.86,;22.53,-37.16,;19.88,-38.71,;21.22,-39.47,;18.58,-39.47,;18.56,-41.01,;17.23,-41.79,;15.9,-41.04,;17.25,-43.33,;15.91,-44.11,;14.59,-43.34,;13.24,-44.12,;11.89,-43.34,;13.24,-45.68,;15.92,-45.65,;14.59,-46.41,;17.26,-46.4,;17.25,-47.93,;18.6,-48.71,;15.91,-48.69,;15.9,-50.23,;14.59,-47.92,;13.26,-48.67,;13.24,-50.22,;11.91,-50.99,;10.65,-50.12,;9.44,-51.05,;9.95,-52.5,;11.48,-52.46,;11.93,-47.91,;10.59,-48.67,;11.94,-46.37,;2.61,-44.04,;3.96,-43.25,;1.26,-43.26,;-2.73,-45.59,;-4.06,-46.37,;-2.73,-44.05,)|
Structure:
Search PDB for entries with ligand similarity: