Compile Data Set for Download or QSAR

Found 159 hits with Last Name = 'schmiedeberg' and Initial = 'n'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646438 (US11878973, Example 40) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(F)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646432 (US11878973, Example 37) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(c(F)c1C)C(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646458 (US11878973, Example 50) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(F)c(cc1C)C(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646369 (US11878973, Example 13) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(Cl)c(cc1C)C(F)(F)F)N1CCCC(F)C1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646481 (N-(2-chloro-4-(trifluoromethyl)phenyl)-2-(2-(3,6-d...) Show SMILES CCc1c(N2CCN([C@H]3CC[C@H]23)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |r,t:51| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646457 (US11878973, Example 113) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=COCCO1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Urokinase plasminogen activator surface receptor (Homo sapiens (Human))	BDBM50120747 (CHEMBL412236 | cyclic uPA-derived peptide) Show SMILES CC(C)C[C@H]1NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C46H71N15O16S2/c1-20(2)12-26-40(70)57-27(13-22-16-51-19-52-22)41(71)53-24(7-9-32(48)62)39(69)60-36(21(3)4)45(75)61-11-5-6-31(61)44(74)59-30(43(73)58-29(46(76)77)15-34(50)64)18-79-78-17-23(47)37(67)55-28(14-33(49)63)42(72)54-25(38(68)56-26)8-10-35(65)66/h16,19-21,23-31,36H,5-15,17-18,47H2,1-4H3,(H2,48,62)(H2,49,63)(H2,50,64)(H,51,52)(H,53,71)(H,54,72)(H,55,67)(H,56,68)(H,57,70)(H,58,73)(H,59,74)(H,60,69)(H,65,66)(H,76,77)/t23-,24+,25-,26+,27-,28+,29-,30-,31+,36-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universität München Curated by ChEMBL					Assay Description Inhibitory activity of the compound against human Urokinase plasminogen activator receptor (uPAR) was determined				J Med Chem 45: 4984-94 (2002) BindingDB Entry DOI: 10.7270/Q2P84B7C
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646440 (US11878973, Example 41) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nc(C)cc(F)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646393 (US11878973, Example 81b) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCC(CC1)OC |t:46| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646391 (US11878973, Example 81a) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CC[C@@H](CC1)OC |r,t:46| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646419 (US11878973, Example 94) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(F)c(cc1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646383 (US11878973, Example 79) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(c(F)c1C)C(F)(F)F)C1=COCCO1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646460 (US11878973, Example 51) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)S(F)(F)(F)(F)F)C1=CCOCC1 |t:50| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646462 (US11878973, Example 52) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncncc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)S(F)(F)(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646427 (US11878973, Example 98) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(OC(F)(F)F)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:52| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646465 (US11878973, Example 117) Show SMILES Cc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |t:45| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646351 (US11878973, Example 4) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(Cl)c(cc1C)C(F)(F)F)N1CCOCC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646436 (US11878973, Example 39) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646356 (US11878973, Example 66) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646434 (US11878973, Example 38) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(c(F)c1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646362 (US11878973, Example 69) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(Cl)c(cc1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646409 (US11878973, Example 89) Show SMILES C[C@@H]1CN(CCN1C(=O)c1ncccc1O)c1c(C)n(CC(=O)Nc2ccc(cc2)C(F)(F)F)c2nc(nn2c1=O)C1=CCOCC1 |r,t:46| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646415 (US11878973, Example 92) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1F)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646399 (US11878973, Example 84) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCCCO1 |t:46| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646372 (US11878973, Example 74) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nc(C)ccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646368 (US11878973, Example 72) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |t:46| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646354 (US11878973, Example 65) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncc(Cl)cc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646348 (US11878973, Example 62) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nc(C)cc(F)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646346 (US11878973, Example 61) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646345 (US11878973, Example 1) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)N1CCOCC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Urokinase plasminogen activator surface receptor (Homo sapiens (Human))	BDBM50120746 (CHEMBL405302 | cyclic uPA-derived peptide) Show SMILES CC(C)[C@@H]1NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](Cc2cccc3ccccc23)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H]2CCCN2C1=O)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C53H71N15O16S2/c1-25(2)43-52(82)68-16-6-11-38(68)51(81)66-37(50(80)65-36(53(83)84)20-41(57)71)23-86-85-22-30(54)44(74)62-35(19-40(56)70)49(79)61-32(13-15-42(72)73)45(75)63-33(17-27-9-5-8-26-7-3-4-10-29(26)27)47(77)64-34(18-28-21-58-24-59-28)48(78)60-31(46(76)67-43)12-14-39(55)69/h3-5,7-10,21,24-25,30-38,43H,6,11-20,22-23,54H2,1-2H3,(H2,55,69)(H2,56,70)(H2,57,71)(H,58,59)(H,60,78)(H,61,79)(H,62,74)(H,63,75)(H,64,77)(H,65,80)(H,66,81)(H,67,76)(H,72,73)(H,83,84)/t30-,31+,32-,33+,34-,35+,36-,37-,38+,43-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universität München Curated by ChEMBL					Assay Description Inhibitory activity of the compound against human Urokinase plasminogen activator receptor (uPAR) was determined				J Med Chem 45: 4984-94 (2002) BindingDB Entry DOI: 10.7270/Q2P84B7C
					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646489 (N-(2-chloro-4-(trifluoromethyl)phenyl)-2-(2-(3,6-d...) Show SMILES CCc1c(N2CCN(CC2)S(=O)(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646374 (US11878973, Example 75) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646445 (US11878973, Example 107) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1F)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646421 (US11878973, Example 95) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(F)c(cc1C)C(F)(F)F)C1=CCOCC1 |t:49| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646423 (US11878973, Example 96) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	MCE PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646443 (US11878973, Example 106) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(Br)cc1Cl)C1=CCOCC1 |t:45| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646431 (US11878973, Example 100) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)S(F)(F)(F)(F)F)C1=CCOCC1 |t:50| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646474 (US11878973, Example 58) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	MCE PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646385 (US11878973, Example 80) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CCC(CC1)OC |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Urokinase plasminogen activator surface receptor (Homo sapiens (Human))	BDBM50120740 (CHEMBL405999 | cyclic uPA-derived peptide) Show SMILES CCCC[C@@H]1NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](CC(C)C)NC1=O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C47H75N15O14S2/c1-6-7-9-26-39(67)57-28(14-22(2)3)41(69)58-29(15-24-18-52-21-53-24)42(70)55-27(11-12-34(49)63)40(68)61-37(23(4)5)46(74)62-13-8-10-33(62)45(73)60-32(44(72)59-31(47(75)76)17-36(51)65)20-78-77-19-25(48)38(66)56-30(16-35(50)64)43(71)54-26/h18,21-23,25-33,37H,6-17,19-20,48H2,1-5H3,(H2,49,63)(H2,50,64)(H2,51,65)(H,52,53)(H,54,71)(H,55,70)(H,56,66)(H,57,67)(H,58,69)(H,59,72)(H,60,73)(H,61,68)(H,75,76)/t25-,26-,27+,28+,29-,30+,31-,32-,33+,37-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Technische Universität München Curated by ChEMBL					Assay Description Inhibitory activity of the compound against human Urokinase plasminogen activator receptor (uPAR) was determined				J Med Chem 45: 4984-94 (2002) BindingDB Entry DOI: 10.7270/Q2P84B7C
					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646483 (US11878973, Example 134) Show SMILES Oc1cccnc1C(=O)N1CCN(CC1)c1c(C2CC2)n(CC(=O)Nc2ccc(cc2)C(F)(F)F)c2nc(nn2c1=O)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646422 (US11878973, Example 32) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)C1=CCCCO1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646463 (US11878973, Example 116) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(F)c(cc1Cl)C(F)(F)F)C1=CCOCC1 |t:48| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646361 (US11878973, Example 9) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)N1CCOCC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646349 (US11878973, Example 3) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(F)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1Cl)C(F)(F)F)N1CCOCC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646355 (US11878973, Example 6) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2nccc(Cl)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1cc(F)c(cc1C)C(F)(F)F)N1CCOCC1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646366 (US11878973, Example 71) Show SMILES CCc1c(N2CCN([C@H](C)C2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |r,t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646370 (US11878973, Example 73) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncnc(C)c2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1)C(F)(F)F)C1=CCOCC1 |t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN [517-1238] (Homo sapiens (Human))	BDBM646387 (US11878973, Example 80a) Show SMILES CCc1c(N2CCN(CC2)C(=O)c2ncccc2O)c(=O)n2nc(nc2n1CC(=O)Nc1ccc(cc1C)C(F)(F)F)C1=CC[C@@H](CC1)OC |r,t:47| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair

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