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ChEMBL ligand: CHEMBL1166 (Acova, Argatroban, Argatroban anhydrous, Argatroban hydrate, Argatroban in dextrose, Argatroban in sodium chloride, Argatroban monohydrate, Argipidine, DK-7419, GN-1600, GN1600, MCI-9038, MD-805) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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coagulation factor X/Coagulation factor X in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL244] [GtoPdb: 2359] [UniProtKB: P00742] | ||||||||
ChEMBL | Inhibition of human factor 10a | B | 4.28 | pKi | 53000 | nM | Ki | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
coagulation factor II, thrombin/Thrombin in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL204] [GtoPdb: 2362] [UniProtKB: P00734] | ||||||||
ChEMBL | Binding affinity to thrombin (unknown origin) by surface plasmon resonance analysis | B | 8.62 | pKd | 2.42 | nM | Kd | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
ChEMBL | Inhibition of human plasma thrombin using chromogenix AB as substrate after 30 secs by UV-spectrophotometry | B | 7.4 | pKi | 40 | nM | Ki | J Med Chem (2018) 61: 2166-2210 [PMID:28850227] |
ChEMBL | Inhibition against clot-associated thrombin. | B | 7.41 | pKi | 39 | nM | Ki | J Med Chem (2000) 43: 305-341 [PMID:10669559] |
ChEMBL | In vitro binding affinity by measuring the inhibition of human thrombin | B | 7.7 | pKi | 20 | nM | Ki | J Med Chem (1994) 37: 3889-3901 [PMID:7966150] |
GtoPdb | - | - | 7.7 | pKi | 19 | nM | Ki |
Thromb Res (1997) 88: 245-50 [PMID:9361377]; Clin Appl Thromb Hemost (2018) 24: 287-294 [PMID:28320219] |
ChEMBL | Inhibitory activity against thrombin. | B | 7.72 | pKi | 19 | nM | Ki | J Med Chem (2002) 45: 4419-4432 [PMID:12238922] |
ChEMBL | Inhibitory activity against human thrombin (using Chromozym TH as the substrate) | B | 7.72 | pKi | 19 | nM | Ki | J Med Chem (2000) 43: 1793-1806 [PMID:10794696] |
ChEMBL | Inhibition of human alpha-thrombin. | B | 8 | pKi | 10 | nM | Ki | J Med Chem (1996) 39: 3039-3043 [PMID:8759623] |
ChEMBL | Binding affinity determined against human alpha thrombin | B | 8 | pKi | 9.9 | nM | Ki | J Med Chem (2005) 48: 1984-2008 [PMID:15771442] |
ChEMBL | Inhibition of human thrombin | B | 8.35 | pKi | 4.5 | nM | Ki | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
ChEMBL | In vitro inhibition constant (Ki) against human thrombin | B | 8.4 | pKi | 4 | nM | Ki | J Med Chem (2003) 46: 3612-3622 [PMID:12904065] |
ChEMBL | Inhibition of thrombin (unknown origin) assessed as fibrin clot formation | B | 5.8 | pIC50 | 1580 | nM | IC50 | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
ChEMBL | Inhibition of thrombin | B | 6.22 | pIC50 | 600 | nM | IC50 | Bioorg Med Chem Lett (1997) 7: 533-538 |
ChEMBL | Inhibitory activity against thrombin | B | 6.26 | pIC50 | 550 | nM | IC50 | Bioorg Med Chem Lett (1999) 9: 1227-1232 [PMID:10340604] |
ChEMBL | Inhibitory activity against human thrombin | B | 6.48 | pIC50 | 331 | nM | IC50 | J Med Chem (2005) 48: 7592-7603 [PMID:16302799] |
ChEMBL | Inhibition of plasma clot-bound thrombin (unknown origin) using S2238 as substrate | B | 7.03 | pIC50 | 92.4 | nM | IC50 | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
ChEMBL | Inhibitory activity against thrombin induced platelet aggregation | B | 7.28 | pIC50 | 52 | nM | IC50 | J Med Chem (1996) 39: 3039-3043 [PMID:8759623] |
ChEMBL | In vitro ability to inhibit the activity of human alpha Thrombin | B | 7.41 | pIC50 | 39 | nM | IC50 | Bioorg Med Chem Lett (1997) 7: 2205-2210 |
ChEMBL | In vitro inhibitory activity against hydrolysis of human alpha thrombin | B | 7.42 | pIC50 | 38 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 45-49 [PMID:11738570] |
ChEMBL | In vitro inhibition of thrombin catalytic activity using s-2238 substrate at 10 uM was measured at rat after 3 min incubation with compound | F | 7.42 | pIC50 | 38 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 41-44 [PMID:11738569] |
ChEMBL | Inhibition of human thrombin assessed as reduction in release of free nitroaniline using tosyl-glycyl-prolyl-arginine-4-nitranilide acetate as substrate preincubated for 10 mins followed by substrate addition by spectrophotometer | B | 7.93 | pIC50 | 11.7 | nM | IC50 | Bioorg Med Chem (2017) 25: 458-470 [PMID:27884512] |
ChEMBL | Inhibition of free thrombin (unknown origin) using S2238 as substrate | B | 7.97 | pIC50 | 10.6 | nM | IC50 | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
ChEMBL | Inhibition of thrombin in human blood using fluorogenic Ac-FVR-AMC as substrate incubated for 10 mins by fluorescence based microplate reader method | B | 8.02 | pIC50 | 9.46 | nM | IC50 | Eur J Med Chem (2022) 228: 114035-114035 [PMID:34902735] |
ChEMBL | Inhibition of human thrombin using Ac-FVR-AMC as substrate incubated for 10 mins prior to substrate addition measured for 10 min by fluorescence assay | B | 8.02 | pIC50 | 9.46 | nM | IC50 | Eur J Med Chem (2015) 96: 122-138 [PMID:25874337] |
ChEMBL | Inhibition of human thrombin | B | 8.27 | pIC50 | 5.4 | nM | IC50 | J Nat Prod (2007) 70: 1570-1577 [PMID:17883259] |
ChEMBL | Inhibition of human thrombin using tosyl-glycyl-prolyl-arginine-4-nitranilide acetate as substrate preincubated for 10 mins by spectrophotometer analysis | B | 8.41 | pIC50 | 3.88 | nM | IC50 | Bioorg Med Chem (2015) 23: 7405-7416 [PMID:26537784] |
Thrombin in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4471] [UniProtKB: P00735] | ||||||||
ChEMBL | Inhibitory activity against bovine thrombin | B | 7.07 | pKi | 85 | nM | Ki | J Med Chem (1999) 42: 4584-4603 [PMID:10579821] |
ChEMBL | Inhibitory activity against bovine thrombin | B | 7.21 | pKi | 61 | nM | Ki | J Med Chem (1999) 42: 4584-4603 [PMID:10579821] |
ChEMBL | Inhibition of bovine plasma thrombin using chromogenix AB as substrate after 30 secs by UV-spectrophotometry | B | 7.7 | pKi | 20 | nM | Ki | J Med Chem (2018) 61: 2166-2210 [PMID:28850227] |
ChEMBL | Inhibitory activity against thrombin. | B | 8.02 | pKi | 9.6 | nM | Ki | J Med Chem (1997) 40: 3091-3099 [PMID:9301673] |
plasminogen activator, tissue type/Tissue-type plasminogen activator in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1873] [GtoPdb: 2392] [UniProtKB: P00750] | ||||||||
ChEMBL | Inhibition of human t-PA | B | 4.06 | pKi | 87800 | nM | Ki | Bioorg Med Chem Lett (2013) 23: 4779-4784 [PMID:23899618] |
Trypsin I in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3769] [UniProtKB: P00760] | ||||||||
ChEMBL | Inhibition of bovine trypsin | B | 5.54 | pKi | 2900 | nM | Ki | J Med Chem (1996) 39: 3039-3043 [PMID:8759623] |
ChEMBL | In vitro ability to inhibit the activity of Trypsin | B | 5.3 | pIC50 | 5000 | nM | IC50 | Bioorg Med Chem Lett (1997) 7: 2205-2210 |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]