Detailed information for compound 1621785

Basic information

Technical information
  • TDR Targets ID: 1621785
  • Name: N-[12-(naphthalene-1-carbonylamino)dodecyl]na phthalene-1-carboxamide
  • MW: 508.694 | Formula: C34H40N2O2
  • H donors: 2 H acceptors: 2 LogP: 9.35 Rotable bonds: 17
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(c1cccc2c1cccc2)NCCCCCCCCCCCCNC(=O)c1cccc2c1cccc2
  • InChi: 1S/C34H40N2O2/c37-33(31-23-15-19-27-17-9-11-21-29(27)31)35-25-13-7-5-3-1-2-4-6-8-14-26-36-34(38)32-24-16-20-28-18-10-12-22-30(28)32/h9-12,15-24H,1-8,13-14,25-26H2,(H,35,37)(H,36,38)
  • InChiKey: NLPMTOQOCINRLW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[12-[(1-naphthyl-oxomethyl)amino]dodecyl]-1-naphthalenecarboxamide
  • N-[12-(naphthalene-1-carbonylamino)dodecyl]-1-naphthamide
  • N-[12-(naphthalen-1-ylcarbonylamino)dodecyl]naphthalene-1-carboxamide
  • NCI60_009658
  • NSC629739

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0555 0.1831 0.3535
Echinococcus granulosus Niemann Pick C1 protein 0.0144 0.0364 0.0359
Loa Loa (eye worm) hypothetical protein 0.0152 0.0396 0.0391
Chlamydia trachomatis 3-oxoacyl-ACP synthase 0.0245 0.0726 1
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.1037 0.355 0.6981
Mycobacterium tuberculosis Hypothetical protein 0.0294 0.0901 0.1669
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0049 0.0049
Schistosoma mansoni alcohol dehydrogenase 0.0061 0.0068 0.0068
Mycobacterium ulcerans polyketide synthase MbtC 0.0245 0.0726 0.1319
Schistosoma mansoni 3-oxoacyl-[ACP] synthase 0.0245 0.0726 0.0726
Brugia malayi Muscleblind-like protein 0.0152 0.0396 0.039
Echinococcus multilocularis 3 oxoacyl (acyl carrier protein) synthase 0.0245 0.0726 0.0721
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0633 0.2111 0.586
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0106 0.0229 0.0322
Mycobacterium ulcerans fatty acid synthase Fas 0.0307 0.0946 0.1759
Brugia malayi Niemann-Pick C1 protein precursor 0.01 0.021 0.0205
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.014 0.0351 0.4269
Brugia malayi AMP-binding enzyme family protein 0.0919 0.313 0.3127
Loa Loa (eye worm) hypothetical protein 0.0061 0.0068 0.0063
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.01 0.0207 0.0279
Echinococcus granulosus acyl carrier protein mitochondrial 0.0099 0.0203 0.0198
Echinococcus multilocularis Niemann Pick C1 protein 0.01 0.021 0.0205
Mycobacterium tuberculosis Probable thioesterase TesA 0.0813 0.2753 0.5384
Schistosoma mansoni patched 1 0.0043 0.0006 0.0006
Mycobacterium ulcerans acyl carrier protein 0.0099 0.0203 0.0271
Giardia lamblia Methyltransferase like 2 0.0294 0.0901 0.5
Schistosoma mansoni [ACP] S-malonyltransferase 0.0062 0.0072 0.0072
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0976 0.3334 0.6547
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0061 0.0068 0.0698
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0102 0.0216 0.0216
Mycobacterium leprae conserved hypothetical protein 0.0099 0.0203 0.0271
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0061 0.0068 0.0698
Mycobacterium tuberculosis Conserved protein 0.0294 0.0901 0.1669
Wolbachia endosymbiont of Brugia malayi acyl carrier protein 0.0099 0.0203 0.2059
Mycobacterium ulcerans thioesterase 0.0813 0.2753 0.5384
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.1459 0.5056 1
Plasmodium falciparum acyl carrier protein 0.0099 0.0203 0.2016
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0494 0.1615 0.4438
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0106 0.0229 0.0322
Echinococcus granulosus geminin 0.0173 0.047 0.0465
Mycobacterium tuberculosis Probable polyketide synthase Pks17 0.0239 0.0703 0.1272
Loa Loa (eye worm) STE/STE11/ASK protein kinase 0.0861 0.2923 0.2923
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0946 0.3227 0.6333
Onchocerca volvulus Acyl carrier protein, mitochondrial homolog 0.0099 0.0203 0.0223
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks3 0.015 0.0386 0.0637
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0976 0.3334 0.333
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.015 0.0386 0.0637
Echinococcus multilocularis AMP dependent ligase 0.01 0.0207 0.0202
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0049 0.0043
Schistosoma mansoni [ACP] S-malonyltransferase 0.0062 0.0072 0.0072
Loa Loa (eye worm) acyl carrier protein 0.0449 0.1453 0.145
Mycobacterium tuberculosis Meromycolate extension acyl carrier protein AcpM 0.0099 0.0203 0.0271
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0106 0.0229 0.0322
Echinococcus multilocularis NADH dehydrogenase 0.0099 0.0203 0.0198
Loa Loa (eye worm) fatty acid synthase 0.0963 0.3287 0.3289
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0245 0.0726 0.2304
Mycobacterium ulcerans non-ribosomal peptide synthetase 0.01 0.0207 0.0279
Loa Loa (eye worm) beta-ketoacyl synthase domain-containing protein 0.0245 0.0726 0.0722
Schistosoma mansoni [ACP] S-malonyltransferase 0.0062 0.0072 0.0072
Treponema pallidum acyl carrier protein 0.0099 0.0203 0.5
Trypanosoma brucei acyl transferase-like protein 0.0062 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.0062 0.0072 0.0066
Loa Loa (eye worm) hypothetical protein 0.0061 0.0068 0.0063
Echinococcus granulosus Malonyl coenzyme A acyl carrier protein transacylase 0.0062 0.0072 0.0066
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0049 0.0043
Mycobacterium ulcerans Type I modular polyketide synthase 0.0976 0.3334 0.6547
Plasmodium falciparum 3-oxoacyl-acyl-carrier protein synthase I/II 0.0245 0.0726 1
Mycobacterium tuberculosis Polyketide synthase Pks13 0.1459 0.5056 1
Loa Loa (eye worm) hypothetical protein 0.0061 0.0068 0.0063
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0245 0.0726 0.1319
Onchocerca volvulus 0.0919 0.313 0.5053
Loa Loa (eye worm) hypothetical protein 0.01 0.021 0.0205
Trypanosoma cruzi Acyl carrier protein, mitochondrial, putative 0.0099 0.0203 0.0474
Mycobacterium ulcerans acyl-CoA synthetase 0.0106 0.0229 0.0322
Trypanosoma cruzi beta-ketoacyl synthase family protein, putative 0.0245 0.0726 0.2304
Mycobacterium tuberculosis Probable polyketide beta-ketoacyl synthase Pks4 0.015 0.0386 0.0637
Toxoplasma gondii type I fatty acid synthase 0.015 0.0386 0.0912
Schistosoma mansoni hypothetical protein 0.0173 0.047 0.047
Leishmania major beta-ketoacyl synthase family protein, putative,3-oxoacyl-acyl carrier protein synthase ii, putative 0.0245 0.0726 0.7899
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0861 0.2923 1
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.1037 0.355 0.6981
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.185 0.6452 0.645
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0976 0.3334 0.6547
Echinococcus granulosus 3 oxoacyl acyl carrier protein synthase 0.0245 0.0726 0.0721
Plasmodium vivax hypothetical protein, conserved 0.014 0.0351 0.4269
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.015 0.0386 0.0637
Toxoplasma gondii acyl carrier protein ACP 0.0099 0.0203 0.0389
Echinococcus multilocularis expressed conserved protein 0.0094 0.0188 0.0183
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0061 0.0068 0.0698
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0785 0.2653 0.5183
Mycobacterium leprae Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase) 0.0106 0.0229 0.0322
Leishmania major acyl carrier protein, putative 0.0099 0.0203 0.1626
Mycobacterium ulcerans 3-oxoacyl-(acyl carrier protein) synthase II 0.0245 0.0726 0.1319
Mycobacterium ulcerans polyketide synthase MbtD 0.03 0.0922 0.1713
Echinococcus multilocularis Acyl carrier protein, mitochondrial 0.0099 0.0203 0.0198
Trypanosoma cruzi acyl transferase-like protein, putative 0.0062 0.0072 0.0012
Toxoplasma gondii type I fatty acid synthase, putative 0.0695 0.233 0.6491
Echinococcus granulosus Niemann Pick C1 protein 0.01 0.021 0.0205
Mycobacterium tuberculosis Conserved hypothetical protein 0.0099 0.0203 0.0271
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0976 0.3334 0.6547
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0861 0.2923 1
Schistosoma mansoni hypothetical protein 0.0099 0.0203 0.0203
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0646 0.2154 0.4183
Mycobacterium ulcerans polyketide synthase Pks13 0.1459 0.5056 1
Echinococcus multilocularis muscleblind protein 1 0.0152 0.0396 0.039
Wolbachia endosymbiont of Brugia malayi ACP S-malonyltransferase 0.0062 0.0072 0.0053
Loa Loa (eye worm) hypothetical protein 0.2841 0.9985 1
Mycobacterium ulcerans acyl carrier protein 0.0099 0.0203 0.0271
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0061 0.0068 0.0063
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0106 0.0229 0.0322
Plasmodium vivax acyl carrier protein, putative 0.0099 0.0203 0.2016
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0919 0.313 0.3131
Mycobacterium ulcerans polyketide synthase Pks9 0.0646 0.2154 0.4183
Loa Loa (eye worm) hypothetical protein 0.0152 0.0396 0.0391
Mycobacterium leprae PROBABLE FATTY ACID SYNTHASE FAS (FATTY ACID SYNTHETASE) 0.0307 0.0946 0.1759
Mycobacterium ulcerans fatty-acid-CoA ligase FadD9 0.01 0.0207 0.0279
Brugia malayi Alcohol dehydrogenase class III 0.0061 0.0068 0.0063
Echinococcus multilocularis Niemann Pick C1 protein 0.0144 0.0364 0.0359
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.1037 0.355 0.6981
Leishmania major hypothetical protein, conserved 0.0062 0.0072 0.0042
Loa Loa (eye worm) alcohol dehydrogenase class III 0.0061 0.0068 0.0063
Loa Loa (eye worm) acyl carrier protein 0.0099 0.0203 0.0198
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0106 0.0229 0.0322
Onchocerca volvulus 0.0106 0.0229 0.0265
Echinococcus multilocularis muscleblind protein 0.0152 0.0396 0.039
Loa Loa (eye worm) hypothetical protein 0.0857 0.2907 0.2908
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0245 0.0726 0.0721
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0701 0.2353 0.4581
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.1037 0.355 0.6981
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0785 0.2653 0.5183
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0106 0.0229 0.0322
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.0307 0.0946 0.1759
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0106 0.0229 0.0322
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0785 0.2653 0.5183
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0106 0.0229 0.0322
Mycobacterium leprae Probable polyketide synthase Pks1 0.1037 0.355 0.6981
Mycobacterium ulcerans polyketide synthase 0.1037 0.355 0.6981
Mycobacterium ulcerans Type I modular polyketide synthase 0.0976 0.3334 0.6547
Loa Loa (eye worm) phosphopantetheine attachment site family protein 0.0099 0.0203 0.0198
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0976 0.3334 0.6547
Onchocerca volvulus Fatty acid synthase homolog 0.176 0.6129 1
Echinococcus granulosus mitochondrial trans 2 enoyl coenzyme A reductase 0.0061 0.0068 0.0063
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0049 0.0043
Mycobacterium tuberculosis Polyketide synthase Pks12 0.1037 0.355 0.6981
Mycobacterium tuberculosis Probable acyl carrier protein AcpA (ACP) 0.0099 0.0203 0.0271
Chlamydia trachomatis acyl carrier protein 0.0099 0.0203 0.2016
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0049 0.0043
Trichomonas vaginalis conserved hypothetical protein 0.0294 0.0901 1
Brugia malayi Methyltransferase-like protein 4 0.0294 0.0901 0.0896
Brugia malayi Phosphopantetheine attachment site family protein 0.0099 0.0203 0.0198
Mycobacterium leprae Polyketide synthase Pks13 0.1459 0.5056 1
Toxoplasma gondii 3-oxoacyl-acyl-carrier protein synthase I/II, putative 0.0245 0.0726 0.1887
Leishmania major hypothetical protein, conserved 0.0294 0.0901 1
Loa Loa (eye worm) hypothetical protein 0.015 0.0386 0.0381
Loa Loa (eye worm) hypothetical protein 0.0061 0.0068 0.0063
Plasmodium vivax 3-oxoacyl-[acyl-carrier-protein] synthase i/ii, putative 0.0245 0.0726 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0976 0.3334 0.6547
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.01 0.021 0.6405
Echinococcus granulosus AMP dependent ligase 0.01 0.0207 0.0202
Schistosoma mansoni hypothetical protein 0.0173 0.047 0.047
Mycobacterium ulcerans Type I modular polyketide synthase 0.0976 0.3334 0.6547
Toxoplasma gondii type I fatty acid synthase, putative 0.1038 0.3554 1
Trypanosoma brucei Acyl carrier protein, mitochondrial 0.0099 0.0203 0.2059
Loa Loa (eye worm) hypothetical protein 0.0547 0.1803 0.1801
Mycobacterium leprae PROBABLE POLYKETIDE BETA-KETOACYL SYNTHASE PKS4 0.015 0.0386 0.0637
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0061 0.0068 0.0063
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.1037 0.355 0.6981
Echinococcus multilocularis Malonyl coenzyme A acyl carrier protein transacylase 0.0062 0.0072 0.0066
Toxoplasma gondii acyl transferase domain-containing protein 0.0062 0.0072 0.001
Trypanosoma cruzi acyl transferase-like protein 0.0062 0.0072 0.0012
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0106 0.0229 0.0223
Echinococcus granulosus NADH dehydrogenase 0.0099 0.0203 0.0198
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0976 0.3334 0.6547
Echinococcus multilocularis protein dispatched 1 0.0049 0.0027 0.0022
Loa Loa (eye worm) hypothetical protein 0.015 0.0386 0.0381
Trypanosoma brucei beta-ketoacyl-ACP synthase 0.0245 0.0726 1
Brugia malayi AMP-binding enzyme family protein 0.0301 0.0926 0.0921
Echinococcus multilocularis mitochondrial trans 2 enoyl coenzyme A reductase 0.0061 0.0068 0.0063
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0049 0.0049
Echinococcus multilocularis geminin 0.0173 0.047 0.0465
Mycobacterium tuberculosis Polyketide synthetase MbtD (polyketide synthase) 0.03 0.0922 0.1713
Loa Loa (eye worm) hypothetical protein 0.0053 0.004 0.0035
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0049 0.0049
Schistosoma mansoni acyl carrier protein 0.0099 0.0203 0.0203
Entamoeba histolytica acyl-CoA synthetase, putative 0.01 0.0207 0.6261
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0061 0.0068 0.0063
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.0336 0.1049 0.1966
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0813 0.2753 0.5384
Mycobacterium leprae Probable fatty-acid-CoA ligase FadD9 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.01 0.0207 0.0279
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0049 0.0043
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.0798 0.2699 0.5275
Mycobacterium tuberculosis Acyl carrier protein (ACP) MbtL 0.0099 0.0203 0.0271
Entamoeba histolytica acyl-CoA synthetase, putative 0.0123 0.029 1
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.0245 0.0726 1
Schistosoma mansoni zinc binding dehydrogenase 0.0061 0.0068 0.0068
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0946 0.3227 0.6333
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0395 0.126 0.2389
Loa Loa (eye worm) hypothetical protein 0.1641 0.5705 0.5711
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0049 0.0043
Brugia malayi acyl carrier protein, mitochondrial precursor, putative 0.0099 0.0203 0.0198
Mycobacterium ulcerans hypothetical protein 0.0099 0.0203 0.0271
Onchocerca volvulus 0.1706 0.5938 0.9685
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0919 0.313 0.614
Brugia malayi ADP-specific Phosphofructokinase/Glucokinase conserved region family protein 0.0062 0.0072 0.0066
Mycobacterium ulcerans polyketide synthase 0.0976 0.3334 0.6547
Schistosoma mansoni methyltransferase-related 0.0294 0.0901 0.0901
Echinococcus granulosus expressed conserved protein 0.0094 0.0188 0.0183
Mycobacterium ulcerans malonyl CoA-acyl carrier protein transacylase FabD 0.0062 0.0072 0.0007
Echinococcus granulosus muscleblind protein 0.0152 0.0396 0.039
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0646 0.2154 0.4183
Mycobacterium ulcerans thioesterase TesA 0.0813 0.2753 0.5384
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.1037 0.355 0.6981

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5.78 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.504 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.37 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.282 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.194 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.193 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.165 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.035 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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