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Target
Carbonic anhydrase 1
Ligand
BDBM79403
Substrate
n/a
Meas. Tech.
ChEMBL_646953 (CHEMBL1217094)
Ki
231000±n/a nM
Citation
 Carta, F; Temperini, C; Innocenti, A; Scozzafava, A; Kaila, K; Supuran, CT Polyamines inhibit carbonic anhydrases by anchoring to the zinc-coordinated water molecule. J Med Chem 53:5511-22 (2010) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 1
Synonyms:
CA-I | CA1 | CAB | CAH1_HUMAN | Carbonate dehydratase I | Carbonic anhydrase | Carbonic anhydrase 1 (CA I) | Carbonic anhydrase 1 (CA-I) | Carbonic anhydrase 1 (Recombinant CA I) | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase B | Carbonic anhydrase I | Carbonic anhydrase I (CA I) | Carbonic anhydrase I (CA-I) | Carbonic anhydrase I (CAI) | Carbonic anhydrase I (hCA I) | Carbonic anhydrase isoenzyme I (hCA I) | hCA
Type:
Enzyme
Mol. Mass.:
28873.37
Organism:
Homo sapiens (Human)
Description:
P00915
Residue:
261
Sequence:
MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF
  
Inhibitor
Name:
BDBM79403
Synonyms:
3-aminopropyl-[4-(3-aminopropylamino)butyl]amine;hydrochloride | CHEMBL23194 | MLS002472980 | N,N''-bis(3-aminopropyl)butane-1,4-diamine;hydrochloride | N,N''-bis(3-azanylpropyl)butane-1,4-diamine;hydrochloride | N,N'-bis(3-aminopropyl)butane-1,4-diamine | SMR001397086 | Spermine | cid_5351186 | spermidine 3HCl
Type:
Small organic molecule
Emp. Form.:
C10H26N4
Mol. Mass.:
202.3402
SMILES:
NCCCNCCCCNCCCN
Structure:
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