Reaction Details Report a problem with these data
Target
Sodium/hydrogen exchanger 1
Ligand
BDBM50297571
Substrate
n/a
Meas. Tech.
ChEMBL_583577 (CHEMBL1059092)
IC50
1.74±n/a nM
Citation
 Zhang, R; Dong, J; Xu, YG; Hua, WY; Wen, N; You, QD Synthesis and bioactivity of substituted indan-1-ylideneaminoguanidine derivatives. Eur J Med Chem 44:3771-6 (2009) [PubMed]  Article 
Target
Name:
Sodium/hydrogen exchanger 1
Synonyms:
NHE-1 | Na(+)/H(+) exchanger 1 | Nhe1 | SL9A1_RAT | Slc9a1 | Solute carrier family 9 member 1
Type:
PROTEIN
Mol. Mass.:
91655.00
Organism:
Rattus norvegicus
Description:
ChEMBL_862370
Residue:
820
Sequence:
MMLRWSGIWGLYPPRIFPSLLVVVALVGLLPVLRSHGLQLNPTASTIRGSEPPRERSIGDVTTAPSEPLHHPDDRNLTNLYIEHGAKPVRKAFPVLDIDYLHVRTPFEISLWILLACLMKIGFHVIPTISSIVPESCLLIVVGLLVGGLIKGVGETPPFLQSDVFFLFLLPPIILDAGYFLPLRQFTENLGTILIFAVVGTLWNAFFLGGLLYAVCLVGGEQINNIGLLDTLLFGSIISAVDPVAVLAVFEEIHINELLHILVFGESLLNDAVTVVLYHLFEEFASYEYVGISDIFLGFLSFFVVSLGGVFVGVVYGVIAAFTSRFTSHIRVIEPLFVFLYSYMAYLSAELFHLSGIMALIASGVVMRPYVEANISHKSHTTIKYFLKMWSSVSETLIFIFLGVSTVAGSHQWNWTFVISTLLFCLIARVLGVLVLTWFINKFRIVKLTPKDQFIIAYGGLRGAIAFSLGYLLDKKHFPMCDLFLTAIITVIFFTVFVQGMTIRPLVDLLAVKKKQETKRSINEEIHTQFLDHLLTGIEDICGHYGHHHWKDKLNRFNKKYVKKCLIAGERSKEPQLIAFYHKMEMKQAIELVESGGMGKIPSAVSTVSMQNIHPKSAASERILPALSKDKEEEIRKILRSNLQKTRQRLRSYNRHTLVADPYEEAWNQMLLRRQKARQLEQKITNYLTVPAHKLDSPTMSRARIGSDPLAYEPKADLPVITIDPASPQSPESVDLVNEELKGKVLGLKRGPRTTPEEEEEDEDGVIMIRSKEPSSPGTDDVFTPGPSDSPGSQRIQRCLSDPGPHPEPGEGEPFIPKGQ
  
Inhibitor
Name:
BDBM50297571
Synonyms:
CHEMBL561343 | N''-{2-[(5-nitro-1H-benzimidazol-2-yl)thio]-2,3-dihydro-1H-inden-1-ylidene}carbonohydrazonic diamide hydrochloride
Type:
Small organic molecule
Emp. Form.:
C17H15N7O2S
Mol. Mass.:
381.412
SMILES:
NC(N)=NN=C1C(Cc2ccccc12)Sc1nc2ccc(cc2[nH]1)[N+]([O-])=O |w:4.3,(19.8,-22.61,;18.29,-22.3,;17.81,-20.83,;17.27,-23.45,;15.76,-23.13,;14.73,-24.28,;13.2,-24.13,;12.57,-25.53,;13.72,-26.55,;13.72,-28.08,;15.04,-28.85,;16.38,-28.08,;16.37,-26.55,;15.05,-25.79,;12.43,-22.79,;10.88,-22.79,;9.97,-24.05,;8.49,-23.57,;7.15,-24.34,;5.82,-23.57,;5.82,-22.02,;7.15,-21.25,;8.49,-22.02,;9.97,-21.54,;4.48,-21.26,;4.48,-19.71,;3.15,-22.03,)|
Structure:
Search PDB for entries with ligand similarity: