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ChEMBL ligand: CHEMBL34259 (Abitrexate, ADX-2191, Amethopterin, CL 14377, CL-14377, D-amethopterin, D-methotrexate, Ebetrex, EMT-25299, Emtexate high-pot, Emtexate pf, Folex, Jylamvo, Maxtrex, Methotrexate, Methotrexate, d-, Methotrexate, (r)-, Methotrexatum, Methylaminopterin, Metoject, Mexate, Mexate-AQ, Nordimet, NSC-740, Otrexup, Otrexup pfs, R-9985, Rasuvo, Reditrex, Rheumatrex, (r)-methotrexate, R-methotrexate, TCMDC-123832, TCMDC-125488, TCMDC-125858, Trexall, Zlatal) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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AICAR transformylase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2518] [UniProtKB: P31939] | ||||||||
ChEMBL | Inhibition of human full length N-terminal His-tagged ATIC expressed in Chinese Hamster MTXRII-OuaR2-4 R2 cells assessed as reduction in THF formation using 10-CHOTHF as substrate by spectrophotometric method | B | 6.06 | pKi | 880 | nM | Ki | Bioorg Med Chem (2021) 37: 116093-116093 [PMID:33773393] |
ChEMBL | Inhibitory activity against AICAR formyltransferase of Lactobacillus casei | B | 4.7 | pIC50 | >20000 | nM | IC50 | J Med Chem (1988) 31: 150-153 [PMID:3121855] |
Bifunctional dihydrofolate reductase-thymidylate synthase in Trypanosoma cruzi (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1163130] [UniProtKB: Q27793] | ||||||||
ChEMBL | Inhibition of Trypanosoma cruzi DHFR-TS in presence of NADPH by spectrophotometry | B | 6.96 | pIC50 | 110 | nM | IC50 | Bioorg Med Chem (2022) 58: 116577-116577 [PMID:35189560] |
ABCC3/Canalicular multispecific organic anion transporter 2 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2073682] [GtoPdb: 781] [UniProtKB: O88563] | ||||||||
ChEMBL | TP_TRANSPORTER: inhibition of E217betaG uptake in membrane vesicles from Mrp3-expressing Sf9 cells | F | 4.05 | pKi | 90000 | nM | Ki | Pharm Res (2002) 19: 34-41 [PMID:11837698] |
Dihydrofolate reductase in Escherichia coli (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1809] [UniProtKB: P0ABQ4] | ||||||||
ChEMBL | Thermodynamic Dissociation Constant for compound-Tyr31-dihydrofolate reductase (DHFR) complex at pH 9.5 | B | 5.77 | pKd | 1700 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Val31-dihydrofolate reductase (DHFR) complex at pH 9.5 | B | 5.96 | pKd | 1100 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Tyr31-dihydrofolate reductase (DHFR) complex at pH 8 | B | 6.85 | pKd | 140 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Val31-dihydrofolate reductase (DHFR) complex at pH 8 | B | 7.08 | pKd | 84 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Phe31-dihydrofolate reductase (DHFR) complex at pH 9.5 | B | 7.51 | pKd | 31 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Val31-dihydrofolate reductase (DHFR) complex at pH 6 | B | 8.49 | pKd | 3.2 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Tyr31-dihydrofolate reductase (DHFR) complex at pH 6 | B | 8.64 | pKd | 2.3 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Inhibitory activity against dihydrofolate reductase | B | 9 | pKd | <1 | nM | Kd | Bioorg Med Chem Lett (2004) 14: 2285-2289 [PMID:15081026] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Phe31-dihydrofolate reductase (DHFR) complex at pH 8 | B | 10.02 | pKd | 0.1 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Thermodynamic Dissociation Constant for compound-Phe31-dihydrofolate reductase (DHFR) complex at pH 6 | B | 10.64 | pKd | 0.02 | nM | Kd | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Binding constant(Ki) to dihydrofolate reductase (DHFR) Tyr -31 was determined | B | 5.62 | pKi | 2400 | nM | Ki | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Binding constant(Ki) to dihydrofolate reductase (DHFR) Phe -31 was determined | B | 6.48 | pKi | 330 | nM | Ki | J Med Chem (1988) 31: 129-137 [PMID:3275776] |
ChEMBL | Binding affinity against Dihydrofolate reductase of Escherichia coli | B | 10.68 | pKi | 0.02 | nM | Ki | J Med Chem (1985) 28: 303-311 [PMID:3973902] |
ChEMBL | Inhibitory activity against recombinant Escherichia coli dihydrofolate reductase | B | 5.36 | pIC50 | 4400 | nM | IC50 | J Med Chem (2001) 44: 1993-2003 [PMID:11384244] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 7.49 | pIC50 | 32 | nM | IC50 | J Med Chem (2004) 47: 6730-6739 [PMID:15615522] |
ChEMBL | Inhibition of Escherichia coli dihydrofolate reductase (DHFR) | B | 8.05 | pIC50 | 9 | nM | IC50 | J Med Chem (2002) 45: 1942-1948 [PMID:11960504] |
ChEMBL | Inhibitory concentration against Escherichia coli Dihydrofolate reductase | B | 8.05 | pIC50 | 9 | nM | IC50 | J Med Chem (2000) 43: 3125-3133 [PMID:10956221] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.06 | pIC50 | 8.8 | nM | IC50 | J Med Chem (2008) 51: 5789-5797 [PMID:18800768] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.06 | pIC50 | 8.8 | nM | IC50 | Bioorg Med Chem (2012) 20: 4217-4225 [PMID:22739090] |
ChEMBL | Inhibition of Escherichia coli dihydrofolate reductase | B | 8.06 | pIC50 | 8.8 | nM | IC50 | J Med Chem (2009) 52: 4892-4902 [PMID:19719239] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.15 | pIC50 | 7 | nM | IC50 | J Med Chem (2004) 47: 6893-6901 [PMID:15615538] |
ChEMBL | Inhibition of Escherichia coli dihydrofolate reductase at 37 degree C pH 7.4 | B | 8.15 | pIC50 | 7 | nM | IC50 | J Med Chem (2005) 48: 5329-5336 [PMID:16078850] |
ChEMBL | Compound was evaluated as inhibitor of Escherichia coli Dihydrofolate reductase | B | 8.15 | pIC50 | 7 | nM | IC50 | J Med Chem (2003) 46: 591-600 [PMID:12570380] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.18 | pIC50 | 6.6 | nM | IC50 | J Med Chem (2005) 48: 7215-7222 [PMID:16279780] |
ChEMBL | Inhibition of Escherichia coli DHFR at 30 degC under pH 7.4 by spectrophotometry | B | 8.18 | pIC50 | 6.6 | nM | IC50 | Bioorg Med Chem (2010) 18: 953-961 [PMID:20056546] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.18 | pIC50 | 6.6 | nM | IC50 | J Med Chem (2010) 53: 1563-1578 [PMID:20092323] |
ChEMBL | Inhibition of Escherichia coli dihydrofolate reductase | B | 8.18 | pIC50 | 6.6 | nM | IC50 | J Med Chem (2008) 51: 4589-4600 [PMID:18605720] |
ChEMBL | Inhibitory activity against Escherichia coli (ec) Dihydrofolate reductase | B | 8.22 | pIC50 | 6 | nM | IC50 | J Med Chem (2002) 45: 5173-5181 [PMID:12408727] |
ChEMBL | Inhibitory concentration against isolated Escherichia coli Dihydrofolate reductase | B | 8.22 | pIC50 | 6 | nM | IC50 | J Med Chem (2000) 43: 3837-3851 [PMID:11052789] |
ChEMBL | Inhibition of Escherichia coli DHFR by spectrophotometry | B | 8.36 | pIC50 | 4.4 | nM | IC50 | Bioorg Med Chem (2011) 19: 3585-3594 [PMID:21550809] |
ChEMBL | Inhibition of Escherichia coli DHFR | B | 8.52 | pIC50 | 3 | nM | IC50 | J Med Chem (2006) 49: 6977-6986 [PMID:17125251] |
ChEMBL | Inhibitory activity against recombinant ec dihydrofolate reductase(in 50 uM dihydrofolic acid) | B | 8.66 | pIC50 | 2.2 | nM | IC50 | J Med Chem (1996) 39: 1438-1446 [PMID:8691474] |
Dihydrofolate reductase in S.aureus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1681620] [UniProtKB: P0A017] | ||||||||
ChEMBL | Inhibition of Staphylococcus aureus DHFR | B | 9 | pKi | 1 | nM | Ki | ACS Med Chem Lett (2016) 7: 692-696 [PMID:27437079] |
Dihydrofolate reductase in Enterococcus faecium (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3243913] [UniProtKB: P00380] | ||||||||
ChEMBL | Inhibition of Streptococcus faecium dihydrofolate reductase using dihydrofolate as substrate | B | 8.85 | pIC50 | 1.4 | nM | IC50 | J Med Chem (1977) 20: 588-591 [PMID:850245] |
Dihydrofolate reductase in Bacillus anthracis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5270] [UniProtKB: Q81R22] | ||||||||
ChEMBL | Inhibition of Bacillus anthracis DHFR | B | 7.82 | pIC50 | 15 | nM | IC50 | Antimicrob Agents Chemother (2009) 53: 3065-3073 [PMID:19364848] |
ChEMBL | Inhibition of Bacillus anthracis DHFR | B | 7.91 | pIC50 | 12.2 | nM | IC50 | Antimicrob Agents Chemother (2009) 53: 3065-3073 [PMID:19364848] |
Dihydrofolate reductase in Lactobacillus casei (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2902] [UniProtKB: P00381] | ||||||||
ChEMBL | Inhibitory activity against recombinant lc dihydrofolate reductase(in 50 uM dihydrofolic acid) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (1996) 39: 1438-1446 [PMID:8691474] |
ChEMBL | Inhibitory concentration against isolated Lactobacillus casei Dihydrofolate reductase | B | 7.36 | pIC50 | 44 | nM | IC50 | J Med Chem (2000) 43: 3837-3851 [PMID:11052789] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 2) | F | 7.59 | pIC50 | 26 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | Compound was evaluated as inhibitor of Lactobacillus casei Dihydrofolate reductase | B | 7.66 | pIC50 | 22 | nM | IC50 | J Med Chem (2003) 46: 591-600 [PMID:12570380] |
ChEMBL | Inhibition of Lactobacillus casei DHFR | B | 7.66 | pIC50 | 22 | nM | IC50 | J Med Chem (2004) 47: 6893-6901 [PMID:15615538] |
ChEMBL | Inhibition of Lactobacillus casei dihydrofolate reductase at 37 degree C pH 7.4 | B | 7.66 | pIC50 | 22 | nM | IC50 | J Med Chem (2005) 48: 5329-5336 [PMID:16078850] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 6) | F | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 3) | F | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | Evaluated for inhibition of dihydrofolate reductase (DHFR) from Lactobacillus casei | B | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (1988) 31: 2164-2169 [PMID:3184124] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 2) | F | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | Inhibitory activity against dihydrofolate reductase of Lactobacillus casei | B | 7.8 | pIC50 | 16 | nM | IC50 | J Med Chem (1988) 31: 150-153 [PMID:3121855] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 5) | F | 7.82 | pIC50 | 15 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Lactobacillus casei was determined (glutamate residue 4) | F | 7.82 | pIC50 | 15 | nM | IC50 | J Med Chem (1988) 31: 181-185 [PMID:2447278] |
ChEMBL | In vitro inhibition of Dihydrofolate reductase activity against Lactobacillus casei enzyme | F | 7.92 | pIC50 | 12 | nM | IC50 | J Med Chem (1982) 25: 877-880 [PMID:7108907] |
ChEMBL | Inhibitory concentration against Lactobacillus casei Dihydrofolate reductase | B | 7.96 | pIC50 | 11 | nM | IC50 | J Med Chem (2000) 43: 3125-3133 [PMID:10956221] |
ChEMBL | Compound was evaluated for the inhibition of dihydrofolate reductase (DHFR) derived from Lactobacillus casei ATCC 7469 | B | 8 | pIC50 | 10 | nM | IC50 | J Med Chem (1986) 29: 1056-1061 [PMID:3712374] |
ChEMBL | Compound was evaluated for the inhibition of dihydrofolate reductase (DHFR)derived from Lactobacillus casei | B | 8 | pIC50 | 10 | nM | IC50 | J Med Chem (1986) 29: 1786-1789 [PMID:3091834] |
ChEMBL | Ability to inhibit Lactobacillus casei dihydrofolate reductase in vitro was determined | B | 8.02 | pIC50 | 9.6 | nM | IC50 | J Med Chem (1980) 23: 899-903 [PMID:6772788] |
ChEMBL | Inhibitory activity against dihydrofolate reductase of Lactobacillus casei | B | 8.07 | pIC50 | 8.5 | nM | IC50 | J Med Chem (1986) 29: 1754-1760 [PMID:3091832] |
ChEMBL | Concentration required for 50% inhibition against dihydrofolate reductase of Lactobacillus casei | B | 8.1 | pIC50 | 8 | nM | IC50 | J Med Chem (1983) 26: 605-607 [PMID:6403710] |
ChEMBL | Inhibitory activity against dihydrofolate reductase derived from Lactobacillus casei | B | 8.1 | pIC50 | 8 | nM | IC50 | J Med Chem (1986) 29: 1263-1269 [PMID:3100797] |
ChEMBL | inhibitory concentration against Lactobacillus casei DHFR(Dihydro folate reductase). | B | 8.22 | pIC50 | 6 | nM | IC50 | J Med Chem (1995) 38: 3798-3805 [PMID:7562910] |
ChEMBL | Inhibitory concentration for DHFR in Lactobacillus casei | B | 8.22 | pIC50 | 6 | nM | IC50 | J Med Chem (1994) 37: 1169-1176 [PMID:8164259] |
ChEMBL | Inhibition of Lactobacillus casei DHFR | B | 8.22 | pIC50 | 6 | nM | IC50 | J Med Chem (2007) 50: 3283-3289 [PMID:17569517] |
ChEMBL | Inhibition of Lactobacillus casei DHFR by spectrophotometric analysis | B | 8.3 | pIC50 | 5 | nM | IC50 | Bioorg Med Chem (2010) 18: 5081-5089 [PMID:20580561] |
ChEMBL | Inhibition of DCM-resistant Lactobacillus casei DHFR | B | 8.35 | pIC50 | 4.5 | nM | IC50 | J Med Chem (1976) 19: 825-829 [PMID:820858] |
ChEMBL | Inhibition of MTX-resistant Lactobacillus casei dihydrofolate reductase | B | 8.52 | pIC50 | 3 | nM | IC50 | J Med Chem (1977) 20: 1323-1327 [PMID:409842] |
ChEMBL | Inhibition of Lactobacillus casei ATCC 7469 dihydrofolate reductase | B | 8.52 | pIC50 | 3 | nM | IC50 | J Med Chem (1979) 22: 869-874 [PMID:109616] |
ChEMBL | Inhibitory activity against recombinant sf dihydrofolate reductase(in 50 uM dihydrofolic acid) | B | 8.66 | pIC50 | 2.2 | nM | IC50 | J Med Chem (1996) 39: 1438-1446 [PMID:8691474] |
ChEMBL | Compound was tested for the inhibition of dihydrofolate reductase in Bovine liver | B | 8.89 | pIC50 | 1.3 | nM | IC50 | J Med Chem (1994) 37: 1616-1624 [PMID:8201595] |
Dihydrofolate reductase in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6065] [UniProtKB: P9WNX1] | ||||||||
ChEMBL | Inhibition of Mycobacterium tuberculosis His-tagged DHFR assessed as reduction in consumption of NADPH using DHF as substrate measured every 30 secs over 6 mins by spectrophotometric method | B | 7.46 | pIC50 | 35 | nM | IC50 | Eur J Med Chem (2018) 144: 262-276 [PMID:29274493] |
ChEMBL | Inhibition of Mycobacterium tuberculosis H37Rv DHFR expressed in Escherichia coli BL21(DE3) assessed as reduction in consumption of NADPH using DHF as substrate preincubated for 1 min followed by DHF addition and measured for 2 mins by spectrophotometric method | B | 8.06 | pIC50 | 8.8 | nM | IC50 | Bioorg Med Chem (2019) 27: 1421-1429 [PMID:30827867] |
ChEMBL | Inhibition of recombinant Mycobacterium tuberculosis DHFR using 45 uM DHF as substrate by spectrophotometry | B | 8.08 | pIC50 | 8.25 | nM | IC50 | ACS Med Chem Lett (2015) 6: 1140-1144 [PMID:26617968] |
Dihydrofolate reductase in Pneumocystis carinii (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1926] [UniProtKB: P16184] | ||||||||
ChEMBL | Inhibitory activity was determined against dihydrofolate reductase in Pneumocystis carinii. | B | 6.06 | pIC50 | 880 | nM | IC50 | J Med Chem (1995) 38: 4739-4759 [PMID:7490723] |
ChEMBL | Inhibitory concentration against isolated Pneumocystis carinii DHFR (Dihydrofolate reductase) | B | 7.86 | pIC50 | 13.8 | nM | IC50 | J Med Chem (2000) 43: 3837-3851 [PMID:11052789] |
ChEMBL | Inhibitory activity against dihydrofolate reductase in Pneumocystis carinii at 37 centigrade. | B | 8.89 | pIC50 | 1.3 | nM | IC50 | J Med Chem (1995) 38: 4739-4759 [PMID:7490723] |
ChEMBL | Inhibitory activity against Dihydrofolate reductase from Pneumocystis carinii was evaluated using 90 uM dihydrofolic acid as substrate | B | 8.89 | pIC50 | 1.3 | nM | IC50 | J Med Chem (1997) 40: 3040-3048 [PMID:9301666] |
ChEMBL | Inhibitory activity against Pneumocystis carinii dihydrofolate reductase (in 90 uM dihydrofolic acid) | B | 8.89 | pIC50 | 1.3 | nM | IC50 | J Med Chem (1996) 39: 1438-1446 [PMID:8691474] |