Detailed information for compound 44083

Basic information

Technical information
  • TDR Targets ID: 44083
  • Name: 1-(benzenesulfonyl)-N-butylpiperidine-2-carbo xamide
  • MW: 324.438 | Formula: C16H24N2O3S
  • H donors: 1 H acceptors: 3 LogP: 2.55 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCNC(=O)C1CCCCN1S(=O)(=O)c1ccccc1
  • InChi: 1S/C16H24N2O3S/c1-2-3-12-17-16(19)15-11-7-8-13-18(15)22(20,21)14-9-5-4-6-10-14/h4-6,9-10,15H,2-3,7-8,11-13H2,1H3,(H,17,19)
  • InChiKey: SVCLSFSGRLVAQK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(benzenesulfonyl)-N-butyl-piperidine-2-carboxamide
  • 1-(benzenesulfonyl)-N-butyl-2-piperidinecarboxamide
  • N-butyl-1-(phenylsulfonyl)piperidine-2-carboxamide
  • 1-besyl-N-butyl-pipecolinamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens FK506 binding protein 1A, 12kDa Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K09571 FK506-binding protein 4/5, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium berghei peptidyl-prolyl cis-trans isomerase FKBP35, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania donovani peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma congolense peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans hypothetical protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei gambiense peptidylprolyl isomerase-like protein, putative Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium yoelii FK506-binding protein Get druggable targets OG5_126727 All targets in OG5_126727
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania infantum fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania major fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma congolense FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania infantum peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis immunophilin, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium knowlesi peptidyl-prolyl cis-trans isomerase FKBP35, putative Get druggable targets OG5_126727 All targets in OG5_126727
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania mexicana peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) Get druggable targets OG5_126727 All targets in OG5_126727
Neospora caninum Peptidylprolyl isomerase D (Cyclophilin D), related Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania mexicana fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei gambiense peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania donovani fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma japonicum FK506-binding protein 1A, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Schistosoma japonicum ko:K09568 FK506-binding protein 1, putative Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis peptidylprolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania major peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Theileria parva peptidyl-prolyl cis-trans isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania braziliensis peptidylprolyl isomerase-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Leishmania braziliensis fk506-binding protein 1-like protein Get druggable targets OG5_126727 All targets in OG5_126727
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 Get druggable targets OG5_126727 All targets in OG5_126727
Echinococcus multilocularis fk506 binding protein Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
Trichomonas vaginalis fk506-binding protein, putative Get druggable targets OG5_126727 All targets in OG5_126727
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative Get druggable targets OG5_126727 All targets in OG5_126727
Loa Loa (eye worm) FKBP5 protein Get druggable targets OG5_126727 All targets in OG5_126727
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase Get druggable targets OG5_126727 All targets in OG5_126727
Candida albicans one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes Get druggable targets OG5_126727 All targets in OG5_126727
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei macrophage infectivity potentiator, precursor, putative FK506 binding protein 1A, 12kDa 108 aa 107 aa 48.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0496 0.0496
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0065 0.1158 0.5
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.0928 0.0876
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0928 0.0928
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0104 0.233 0.3873
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0092 0.1992 1
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.006 0.1001 0.6096
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.006 0.1001 0.0705
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.765 1
Echinococcus multilocularis 0.006 0.1001 0.1604
Loa Loa (eye worm) hypothetical protein 0.0092 0.1992 0.1825
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0092 0.1992 0.1992
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.006 0.1001 0.6096
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.1171 0.1877
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.006 0.1001 0.0705
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.006 0.1001 0.0705
Leishmania major cytochrome p450-like protein 0.006 0.1001 0.1066
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.5753 0.6415
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.0928 0.1487
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0092 0.1992 0.3192
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.006 0.1001 0.6096
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0928 0.0928
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.0928 0.0928
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0496 0.0795
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.006 0.1001 0.6096
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.006 0.1001 0.0705
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0494 0.0791
Trypanosoma brucei Sterol methyltransferase, putative 0.0199 0.523 1
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.0928 0.1487
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.006 0.1001 0.6096
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0065 0.1158 0.1856
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0232 0.6239 1
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.0065 0.1158 0.7995
Leishmania major fk506-binding protein 1-like protein 0.0065 0.1158 0.1398
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.1171 0.1877
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.006 0.1001 0.0705
Brugia malayi Cytochrome P450 family protein 0.006 0.1001 0.1062
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0496 0.0795
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.006 0.1001 0.0705
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.006 0.1001 0.6096
Brugia malayi Bromodomain containing protein 0.0046 0.0581 0.0574
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.006 0.1001 0.0705
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.006 0.1001 0.0705
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.006 0.1001 0.6096
Leishmania major peptidylprolyl isomerase-like protein 0.0065 0.1158 0.1398
Trypanosoma cruzi cytochrome p450-like protein, putative 0.006 0.1001 0.1066
Trypanosoma brucei cytochrome P450, putative 0.0071 0.1324 0.1748
Loa Loa (eye worm) hypothetical protein 0.0066 0.1171 0.0823
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.1158 0.1398
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.006 0.1001 0.1066
Leishmania major lanosterol 14-alpha-demethylase, putative 0.006 0.1001 0.1066
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.0928 0.0526
Loa Loa (eye worm) hypothetical protein 0.0056 0.0884 0.0473
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative 0.0065 0.1158 0.5
Schistosoma mansoni bromodomain containing protein 0.0076 0.1502 0.1502
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0065 0.1158 0.0807
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.1158 0.1398
Loa Loa (eye worm) cytochrome P450 0.006 0.1001 0.0615
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.006 0.1001 0.0705
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0065 0.1158 0.1856
Echinococcus granulosus cytochrome P450 2K1 0.006 0.1001 0.1604
Echinococcus multilocularis fk506 binding protein 0.0065 0.1158 0.1856
Brugia malayi mbt repeat family protein 0.0058 0.0928 0.0977
Leishmania major sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0065 0.1158 0.1244
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0056 0.0884 0.1417
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0496 0.0496
Loa Loa (eye worm) hypothetical protein 0.0049 0.0671 0.0213
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.006 0.1001 0.6096
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.006 0.1001 0.0705
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.137 0.2196
Brugia malayi Cytochrome P450 family protein 0.0071 0.1324 0.1437
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0081 0.1648 0.2642
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.006 0.1001 0.6096
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.006 0.1001 0.0705
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.1158 0.1398
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0065 0.1158 0.1856
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Brugia malayi beta-lactamase family protein 0.0043 0.0496 0.0475
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.006 0.1001 0.1066
Trypanosoma cruzi sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Schistosoma mansoni hypothetical protein 0.006 0.1001 0.1001
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.006 0.1001 0.6096
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.8691 1
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0065 0.1158 0.0807
Trypanosoma brucei sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Onchocerca volvulus 0.0058 0.0928 0.0876
Brugia malayi Bromodomain containing protein 0.0091 0.1934 0.2147
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.006 0.1001 0.1066
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.006 0.1001 0.6096
Loa Loa (eye worm) hypothetical protein 0.0085 0.1776 0.1562
Loa Loa (eye worm) hypothetical protein 0.0097 0.2122 0.1984
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.1171 0.126
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.8691 1
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0092 0.1992 0.3192
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Leishmania major sterol 24-c-methyltransferase, putative 0.0199 0.523 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0081 0.1648 0.2642
Loa Loa (eye worm) hypothetical protein 0.0058 0.0928 0.0526
Trichomonas vaginalis fk506-binding protein, putative 0.0065 0.1158 0.0807
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.006 0.1001 0.6096
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.0065 0.1158 0.5
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0065 0.1158 0.1398
Trichomonas vaginalis immunophilin, putative 0.0065 0.1158 0.0807
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.006 0.1001 0.0705
Loa Loa (eye worm) CYP4Cod1 0.0071 0.1324 0.101
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0092 0.1992 1
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.006 0.1001 0.6096
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.1171 0.1877
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0232 0.6239 1
Brugia malayi cytochrome P450 0.006 0.1001 0.1062
Schistosoma mansoni immunophilin 0.0065 0.1158 0.1158
Loa Loa (eye worm) cytochrome P450 family protein 0.0071 0.1324 0.101
Brugia malayi S-adenosyl-methionine cycloartenol-C24-methyltransferase 0.0097 0.2122 0.2366
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.0065 0.1158 0.5
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.1158 0.1398
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0065 0.1158 0.1398
Loa Loa (eye worm) hypothetical protein 0.0046 0.0584 0.0106
Brugia malayi Cytochrome P450 family protein 0.0106 0.2408 0.2697
Schistosoma mansoni cytochrome P450 0.006 0.1001 0.1001
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0065 0.1158 0.1244
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.006 0.1001 0.0705
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.006 0.1001 0.0705
Mycobacterium leprae Conserved hypothetical protein 0.006 0.1001 1
Trypanosoma cruzi cytochrome P450, putative 0.0071 0.1324 0.1748
Brugia malayi beta-lactamase 0.0043 0.0496 0.0475
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.0928 0.1487
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.137 0.2196
Brugia malayi mbt repeat family protein 0.0058 0.0928 0.0977
Toxoplasma gondii cytochrome p450 superfamily protein 0.006 0.1001 0.3372
Leishmania major cytochrome p450-like protein 0.006 0.1001 0.1066
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.0081 0.1648 0.1406
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0092 0.1992 0.3192
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0071 0.1324 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.006 0.1001 0.6096
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0065 0.1158 0.0807
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0092 0.1992 0.3192
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.1171 0.1877
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.8691 1
Brugia malayi beta-lactamase family protein 0.0043 0.0496 0.0475
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.0928 0.1487
Leishmania major cytochrome p450-like protein 0.0071 0.1324 0.1748
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.006 0.1001 0.0705
Loa Loa (eye worm) cytochrome P450 family protein 0.0106 0.2408 0.2332
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.006 0.1001 0.0705
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.006 0.1001 0.6096
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.006 0.1001 0.6096
Loa Loa (eye worm) MBCTL1 0.0066 0.1171 0.0823
Loa Loa (eye worm) FKBP5 protein 0.0065 0.1158 0.0807
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0496 0.0475
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.1171 0.1171
Schistosoma mansoni immunophilin 0.0065 0.1158 0.1158
Loa Loa (eye worm) hypothetical protein 0.0052 0.0741 0.0299
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0056 0.0884 0.1417
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.006 0.1001 0.0705
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.5416 1
Brugia malayi Cytochrome P450 family protein 0.0071 0.1324 0.1437
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0065 0.1158 0.1158
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.006 0.1001 0.6096
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.006 0.1001 0.0705
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.006 0.1001 0.6096
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.5753 0.6415
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.006 0.1001 0.6096
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.5416 0.6004
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.006 0.1001 0.0705
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.006 0.1001 0.6096
Schistosoma mansoni immunophilin 0.0056 0.0884 0.0884
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0081 0.1648 0.1814
Loa Loa (eye worm) cytochrome P450 family protein 0.0071 0.1324 0.101
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0494 0.0791
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.0065 0.1158 1
Mycobacterium leprae putative cytochrome p450 0.006 0.1001 1
Trypanosoma cruzi cytochrome P450, putative 0.0071 0.1324 0.1748
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.006 0.1001 0.0705

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 4700 nM Ability to inhibit peptidyl-prolyl isomerase (PPIase, or rotamase) activity of FK506 binding protein 12 ChEMBL. 11992791
Ki (binding) = 4700 nM Ability to inhibit peptidyl-prolyl isomerase (PPIase, or rotamase) activity of FK506 binding protein 12 ChEMBL. 11992791

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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