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TargetA disintegrin and metalloproteinase with thrombospondin motifs 1
LigandBDBM50395677
Substrate/Competitorn/a
Meas. Tech.ChEMBL_860059 (CHEMBL2167995)
IC50>50000±n/a nM
Citation Deng, HO'Keefe, HDavie, CPLind, KEAcharya, RAFranklin, GJLarkin, JMatico, RNeeb, MThompson, MMLohr, TGross, JWCentrella, PAO'Donovan, GKBedard, KLvan Vloten, KMataruse, SSkinner, SRBelyanskaya, SLCarpenter, TYShearer, TWClark, MACuozzo, JWArico-Muendel, CCMorgan, BA Discovery of highly potent and selective small molecule ADAMTS-5 inhibitors that inhibit human cartilage degradation via encoded library technology (ELT). J Med Chem55:7061-79 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
A disintegrin and metalloproteinase with thrombospondin motifs 1
Name:A disintegrin and metalloproteinase with thrombospondin motifs 1
Synonyms:ADAMTS1 | ATS1_HUMAN | KIAA1346 | METH1
Type:PROTEIN
Mol. Mass.:105362.16
Organism:Homo sapiens (Human)
Description:ChEMBL_860059
Residue:967
Sequence:
MQRAVPEGFGRRKLGSDMGNAERAPGSRSFGPVPTLLLLAAALLAVSDALGRPSEEDEEL
VVPELERAPGHGTTRLRLHAFDQQLDLELRPDSSFLAPGFTLQNVGRKSGSETPLPETDL
AHCFYSGTVNGDPSSAAALSLCEGVRGAFYLLGEAYFIQPLPAASERLATAAPGEKPPAP
LQFHLLRRNRQGDVGGTCGVVDDEPRPTGKAETEDEDEGTEGEDEGAQWSPQDPALQGVG
QPTGTGSIRKKRFVSSHRYVETMLVADQSMAEFHGSGLKHYLLTLFSVAARLYKHPSIRN
SVSLVVVKILVIHDEQKGPEVTSNAALTLRNFCNWQKQHNPPSDRDAEHYDTAILFTRQD
LCGSQTCDTLGMADVGTVCDPSRSCSVIEDDGLQAAFTTAHELGHVFNMPHDDAKQCASL
NGVNQDSHMMASMLSNLDHSQPWSPCSAYMITSFLDNGHGECLMDKPQNPIQLPGDLPGT
SYDANRQCQFTFGEDSKHCPDAASTCSTLWCTGTSGGVLVCQTKHFPWADGTSCGEGKWC
INGKCVNKTDRKHFDTPFHGSWGMWGPWGDCSRTCGGGVQYTMRECDNPVPKNGGKYCEG
KRVRYRSCNLEDCPDNNGKTFREEQCEAHNEFSKASFGSGPAVEWIPKYAGVSPKDRCKL
ICQAKGIGYFFVLQPKVVDGTPCSPDSTSVCVQGQCVKAGCDRIIDSKKKFDKCGVCGGN
GSTCKKISGSVTSAKPGYHDIITIPTGATNIEVKQRNQRGSRNNGSFLAIKAADGTYILN
GDYTLSTLEQDIMYKGVVLRYSGSSAALERIRSFSPLKEPLTIQVLTVGNALRPKIKYTY
FVKKKKESFNAIPTFSAWVIEEWGECSKSCELGWQRRLVECRDINGQPASECAKEVKPAS
TRPCADHPCPQWQLGEWSSCSKTCGKGYKKRSLKCLSHDGGVLSHESCDPLKKPKHFIDF
CTMAECS
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  Blast E-value cutoff:
BDBM50395677
n/a
NameBDBM50395677
Synonyms:CHEMBL2164111
TypeSmall organic molecule
Emp. Form.C30H36N8O2S2
Mol. Mass.604.789
SMILESCCCc1ccc(cc1)S(=O)(=O)NC[C@H]1CCCN1c1nc(NCc2csc(n2)-c2ccccc2)nc(NC2CC2)n1 |r|
Structure
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