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BDBM50009930 CHEMBL167761::DB1171

SMILES: NC(=N)c1ccc(cc1)-c1cc2cc(ccc2[nH]1)C(N)=N

InChI Key: InChIKey=JUOBNLRIOAUTBJ-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB:
Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50009930   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thrombin


(Bos taurus (Bovine))
BDBM50009930
PNG
(CHEMBL167761 | DB1171)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)14-8-12-7-11(16(19)20)5-6-13(12)21-14/h1-8,21H,(H3,17,18)(H3,19,20)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.45E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of bovine thrombin using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after 15 to 40 mins ...


J Med Chem 21: 613-23 (1978)


Article DOI: 10.1021/jm00205a005
BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair
Glandular kallikrein


(Sus scrofa)
BDBM50009930
PNG
(CHEMBL167761 | DB1171)
Show SMILES NC(=N)c1ccc(cc1)-c1cc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C16H15N5/c17-15(18)10-3-1-9(2-4-10)14-8-12-7-11(16(19)20)5-6-13(12)21-14/h1-8,21H,(H3,17,18)(H3,19,20)
PDB
MMDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.10E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Competitive reversible inhibition of porcine pancreatic kallikrein using alpha-N-benzoyl-DL-arginine-p-nitroanilide hydrochloride as substrate after ...


J Med Chem 21: 613-23 (1978)


Article DOI: 10.1021/jm00205a005
BindingDB Entry DOI: 10.7270/Q23B61PN
More data for this
Ligand-Target Pair