Reaction Details Report a problem with these data
Target
Endothelin receptor type B
Ligand
BDBM50286238
Substrate
n/a
Meas. Tech.
ChEBML_64186
Ki
6000±n/a nM
Citation
 Murugesan, N; Zhengxiang, Gu; Lee, V; Webb, ML; Liu, EC; Hermsmeier, M; Hunt, JT Design and synthesis of nonpeptidal endothelin receptor antagonists based on the structure of a cyclic pentapeptide Bioorg Med Chem Lett 5:253-258 (1995)    Article 
Target
Name:
Endothelin receptor type B
Synonyms:
EDNRB_RAT | ENDOTHELIN B | ET-B | Ednrb | Endothelin receptor | Endothelin receptor non-selective type
Type:
Enzyme Catalytic Domain
Mol. Mass.:
49483.43
Organism:
RAT
Description:
ENDOTHELIN B EDNRB RAT::P21451
Residue:
442
Sequence:
MQSSASRCGRALVALLLACGLLGVWGEKRGFPPAQATPSLLGTKEVMTPPTKTSWTRGSNSSLMRSSAPAEVTKGGRVAGVPPRSFPPPCQRKIEINKTFKYINTIVSCLVFVLGIIGNSTLLRIIYKNKCMRNGPNILIASLALGDLLHIIIDIPINAYKLLAGDWPFGAEMCKLVPFIQKASVGITVLSLCALSIDRYRAVASWSRIKGIGVPKWTAVEIVLIWVVSVVLAVPEAIGFDVITSDYKGKPLRVCMLNPFQKTAFMQFYKTAKDWWLFSFYFCLPLAITAIFYTLMTCEMLRKKSGMQIALNDHLKQRREVAKTVFCLVLVFALCWLPLHLSRILKLTLYDQSNPQRCELLSFLLVLDYIGINMASLNSCINPIALYLVSKRFKNCFKSCLCCWCQTFEEKQSLEEKQSCLKFKANDHGYDNFRSSNKYSSS
  
Inhibitor
Name:
BDBM50286238
Synonyms:
CHEMBL314364 | {8-[(1H-Indole-2-carbonyl)-amino]-11-oxo-5-propyl-5,11-dihydro-dibenzo[b,e][1,4]diazepin-10-yl}-acetic acid
Type:
Small organic molecule
Emp. Form.:
C27H24N4O4
Mol. Mass.:
468.5039
SMILES:
CCCN1c2ccc(NC(=O)c3cc4ccccc4[nH]3)cc2N(CC(O)=O)C(=O)c2ccccc12
Structure:
Search PDB for entries with ligand similarity: