Ki Summary

Reaction Details

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Target

Plasminogen

Ligand

BDBM50431218

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_948828 (CHEMBL2340210)

14200±n/a nM

Citation

Baeriswyl, V; Calzavarini, S; Gerschheimer, C; Diderich, P; Angelillo-Scherrer, A; Heinis, C Development of a selective peptide macrocycle inhibitor of coagulation factor XII toward the generation of a safe antithrombotic therapy. J Med Chem56:3742-6 (2013) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Plasminogen

Name:

Plasminogen

Synonyms:

Type:

Enzyme

Mol. Mass.:

90579.18

Organism:

Homo sapiens (Human)

Description:

n/a

Residue:

810

Sequence:

MEHKEVVLLLLLFLKSGQGEPLDDYVNTQGASLFSVTKKQLGAGSIEECAAKCEEDEEFT
CRAFQYHSKEQQCVIMAENRKSSIIIRMRDVVLFEKKVYLSECKTGNGKNYRGTMSKTKN
GITCQKWSSTSPHRPRFSPATHPSEGLEENYCRNPDNDPQGPWCYTTDPEKRYDYCDILE
CEEECMHCSGENYDGKISKTMSGLECQAWDSQSPHAHGYIPSKFPNKNLKKNYCRNPDRE
LRPWCFTTDPNKRWELCDIPRCTTPPPSSGPTYQCLKGTGENYRGNVAVTVSGHTCQHWS
AQTPHTHNRTPENFPCKNLDENYCRNPDGKRAPWCHTTNSQVRWEYCKIPSCDSSPVSTE
QLAPTAPPELTPVVQDCYHGDGQSYRGTSSTTTTGKKCQSWSSMTPHRHQKTPENYPNAG
LTMNYCRNPDADKGPWCFTTDPSVRWEYCNLKKCSGTEASVVAPPPVVLLPDVETPSEED
CMFGNGKGYRGKRATTVTGTPCQDWAAQEPHRHSIFTPETNPRAGLEKNYCRNPDGDVGG
PWCYTTNPRKLYDYCDVPQCAAPSFDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRT
RFGMHFCGGTLISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVNLEPHVQEIEVSRLFLE
PTRKDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGAGLLKEAQ
LPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDSGGPLVCFEKDKYILQGVTSW
GLGCARPNKPGVYVRVSRFVTWIEGVMRNN

BDBM50431218

n/a

Name

BDBM50431218

Synonyms:

CHEMBL2332606

Type

Small organic molecule

Emp. Form.

C61H96N20O16S3

Mol. Mass.

1461.734

SMILES

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(O)=O |r,wU:43.52,21.21,4.4,73.75,91.94,wD:53.58,28.37,15.18,8.7,64.66,85.88,(34.21,-17.42,;34.19,-18.94,;35.53,-19.73,;32.84,-19.7,;32.82,-21.23,;31.48,-21.98,;30.16,-21.2,;30.17,-19.66,;28.82,-21.95,;28.87,-23.49,;27.22,-23.79,;26.43,-22.32,;27.57,-21.09,;27.4,-19.56,;28.64,-18.65,;25.99,-18.95,;24.75,-19.86,;23.34,-19.25,;25.82,-17.42,;24.41,-16.81,;23.17,-17.71,;24.16,-15.28,;25.41,-14.36,;24.62,-12.88,;22.97,-13.17,;22.73,-14.83,;21.43,-15.65,;21.48,-17.19,;20.07,-14.93,;18.76,-15.75,;18.81,-17.28,;17.51,-18.1,;17.57,-19.64,;16.26,-20.45,;14.9,-19.74,;16.31,-21.99,;20,-13.39,;18.65,-12.67,;18.59,-11.13,;17.35,-13.49,;15.98,-12.77,;14.68,-13.58,;14.73,-15.12,;13.32,-12.86,;13.27,-11.32,;14.57,-10.51,;14.68,-8.97,;16.16,-8.6,;16.98,-9.91,;15.99,-11.08,;12.01,-13.68,;10.66,-12.96,;10.6,-11.42,;9.35,-13.77,;9.41,-15.31,;8.1,-16.13,;7.99,-13.05,;7.93,-11.52,;9.24,-10.7,;6.58,-10.79,;6.52,-9.25,;34.15,-22.02,;34.13,-23.57,;35.48,-21.28,;36.82,-22.07,;36.8,-23.62,;38.11,-24.4,;38.09,-25.96,;36.74,-26.72,;39.4,-26.73,;38.14,-21.32,;38.16,-19.8,;39.48,-22.11,;40.81,-21.37,;40.82,-19.85,;42.18,-19.08,;42.22,-17.57,;43.57,-16.83,;44.88,-17.63,;46.23,-16.87,;44.85,-19.16,;43.51,-19.9,;42.15,-22.16,;42.13,-23.72,;43.47,-21.42,;44.81,-22.21,;44.8,-23.78,;43.43,-24.53,;46.14,-21.47,;46.15,-19.95,;47.48,-22.26,;48.8,-21.51,;48.82,-20,;50.18,-19.24,;50.19,-17.72,;51.55,-16.95,;51.57,-15.43,;50.15,-22.31,;51.47,-21.57,;50.14,-23.88,)|

Structure