Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO18068 | Curcuma phaeocaulis | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO13857 | Mentha canadensis | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO29618 | Citri grandis exocarpium | NA | NA | NA | TCMSP* | |||
NPO2618 | Curcuma wenyujin | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO12182 | Murraya exotica | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO25133 | Cynanchistauntonii rhizoma et radix | NA | NA | NA | TCMSP* | |||
NPO7929 | Curcuma zedoaria | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO2715 | Murraya paniculata | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO29650 | Lysimachiae herba | NA | NA | NA | TCMSP* | |||
NPO4460 | Vincetoxicum glaucescens | Species | Apocynaceae | Eukaryota | TM-MC* | |||
NPO8650 | Perilla frutescens | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO29654 | Lonicerae japonicae flos | NA | NA | NA | TCMSP* | |||
NPO2761 | Cynanchum stauntoni | Species | Apocynaceae | Eukaryota | TM-MC* | |||
NPO11169 | Piper cubeba | Species | Piperaceae | Eukaryota | TM-MC* | |||
NPO26439 | Folium artemisiae argyi | NA | NA | NA | TCMSP* | |||
NPO11170 | Akebia trifoliata | Species | Lardizabalaceae | Eukaryota | TM-MC* | |||
NPO22715 | Alpinia oxyphylla | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO10366 | Vincetoxicum stauntonii | Species | Apocynaceae | Eukaryota | TM-MC* | |||
NPO28928 | Piper nigrum | Species | Piperaceae | Eukaryota | TM-MC* | |||
NPO29555 | Evodiae fructus | NA | NA | NA | TCMSP* | |||
NPO29700 | Peucedani radix | NA | NA | NA | TCMSP* | |||
NPO12265 | Aquilaria agallochum | Species | Thymelaeaceae | Eukaryota | TM-MC* | |||
NPO22796 | Cyperus rotundus | Species | Cyperaceae | Eukaryota | TM-MC* | |||
NPO29463 | Pogostemon cablin | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO25673 | Semen euphorbiae | NA | NA | NA | TCMSP* | |||
NPO14558 | Aquilaria sinensis | Species | Thymelaeaceae | Eukaryota | TM-MC* | |||
NPO163 | Daucus carota | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO8789 | Schizonepeta tenuifolia | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO8650 | Perilla frutescens | Species | Lamiaceae | Eukaryota | TCMSP* | |||
NPO11421 | Arnebia euchroma | Species | Boraginaceae | Eukaryota | TM-MC* | |||
NPO3987 | Syzygium aromaticum | Species | Myrtaceae | Eukaryota | TM-MC* | |||
NPO1880 | Schizonepeta tenuisfolia | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO3041 | Rhizome of whiteback greenbrier | NA | NA | NA | TCMSP* | |||
NPO20297 | Arnebia guttata | Species | Boraginaceae | Eukaryota | TM-MC* | |||
NPO8874 | Glehnia littoralis | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO16039 | Scutellaria barbata | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO24143 | Fructuslipuidambaris | NA | NA | NA | TCMSP* | |||
NPO26589 | Artemisia annua | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO1436 | Houttuynia cordata | Species | Saururaceae | Eukaryota | TM-MC* | |||
NPO12935 | Thymus quinquecostatus | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO28423 | Apocyniveneti folium | NA | NA | NA | TCMSP* | |||
NPO10506 | Artemisia apiacea | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO13879 | Humulus lupulus | Species | Cannabaceae | Eukaryota | TM-MC* | |||
NPO19472 | Thymus vulgaris | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO32512 | polyalthia cerasoides | Species | Annonaceae | Eukaryota | roots |
PMID[17845001] |
||
NPO29570 | Rhapontici radix | NA | NA | NA | TCMSP* | |||
NPO28276 | Artemisia argyi | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO4391 | Hypericum perforatum | Species | Hypericaceae | Eukaryota | TM-MC* | |||
NPO29016 | Valeriana jatamansi | Species | Caprifoliaceae | Eukaryota | TM-MC* | |||
NPO28392 | Macrosiphum liriodendri | Species | Aphididae | Eukaryota | UNPD* | |||
NPO29560 | Carthami flos | NA | NA | NA | TCMSP* | |||
NPO11100 | Artemisia capillaris | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO13274 | Illicium verum | Species | Schisandraceae | Eukaryota | TM-MC* | |||
NPO14602 | Vitex negundo | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO28036 | Distemonanthus benthamianus | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO17399 | Kadsurae coccineae radix et caulis | NA | NA | NA | TCMSP* | |||
NPO10492 | Artemisia montana | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO17755 | Inula helenium | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO10391 | Dolomiaea souliei | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO28510 | Aspergillus pseudodeflectus | Species | Aspergillaceae | Eukaryota | UNPD* | |||
NPO2811 | Calyx seu fructus physalis | Species | Phloeodictyidae | Eukaryota | TCMSP* | |||
NPO25094 | Artemisia princeps | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO28807 | Laggera pterodonta | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO5315 | Zanthoxylum bungeanum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO28218 | Asplenium adiantum-nigrum | Species | Aspleniaceae | Eukaryota | UNPD* | |||
NPO29633 | Ecliptae herba | NA | NA | NA | TCMSP* | |||
NPO12584 | Atractylodes chinensis | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO23548 | Leonurus japonicus | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO9290 | Zanthoxylum piperitum | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO11638 | Cinnanmomi cortex | NA | NA | NA | TCMSP* | |||
NPO29629 | Viticis negundo folium | Species | Curculionidae | Eukaryota | TCMSP* | |||
NPO16087 | Atractylodes lancea | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO11776 | Lithospermum erythrorhizon | Species | Boraginaceae | Eukaryota | TM-MC* | |||
NPO8698 | Zanthoxylum schinifolium | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO29639 | Aucklandiae radix | NA | NA | NA | TCMSP* | |||
NPO6444 | Humulus scandens | Species | Cannabaceae | Eukaryota | TCMSP* | |||
NPO20902 | Atractylodes macrocephala | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO29110 | Litsea cubeba | Species | Lauraceae | Eukaryota | TM-MC* | |||
NPO20553 | Zingiber officinale | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO29581 | Dalbergiae odoriferae lignum | NA | NA | NA | TCMSP* | |||
NPO18840 | Platycladi cacumen | NA | NA | NA | TCMSP* | |||
NPO25825 | Saussurea costus | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO14650 | Lobelia chinensis | Species | Campanulaceae | Eukaryota | TM-MC* | |||
NPO5986 | Ziziphus jujuba | Species | Rhamnaceae | Eukaryota | TM-MC* | |||
NPO7513 | Cannabis sativa | Species | Cannabaceae | Eukaryota | TCMSP* | |||
NPO29589 | Linderae radix | NA | NA | NA | TCMSP* | |||
NPO29401 | Bupleurum chinense | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO1515 | Lonicera japonica | Species | Caprifoliaceae | Eukaryota | TM-MC* | |||
NPO29641 | Rhododendri daurici folium | NA | NA | NA | TCMSP* | |||
NPO5603 | Eupatorium fortunei turcz | Species | Asteraceae | Eukaryota | TCMSP* | |||
NPO3107 | Bupleurum falcatum | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO11791 | Magnolia obovata | Species | Magnoliaceae | Eukaryota | TM-MC* | |||
NPO29705 | Viticis fructus | Species | Curculionidae | Eukaryota | TCMSP* | |||
NPO29463 | Pogostemon cablin | Species | Lamiaceae | Eukaryota | TCMSP* | |||
NPO1484 | Bupleurum scorzonerifolium | Species | Apiaceae | Eukaryota | TM-MC* | |||
NPO24198 | Radix cynanchi paniculati | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO29559 | Cinnamomi ramulus | NA | NA | NA | TCMSP* | |||
NPO28260 | Senna alexandrina | Species | Fabaceae | Eukaryota | TM-MC* | |||
NPO5946 | Caryophylliflos | NA | NA | NA | TCMSP* | |||
NPO29556 | Piperis longi fructus | NA | NA | NA | TCMSP* | |||
NPO22258 | Chrysanthemum indicum | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO29697 | Menthae herba | NA | NA | NA | TCMSP* | |||
NPO29558 | Anemarrhenae rhizoma | NA | NA | NA | TCMSP* | |||
NPO20440 | Chrysanthemum x morifolium | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO29715 | Litchi chinensis | Species | Sapindaceae | Eukaryota | TCMSP* | |||
NPO25682 | Acorus calamus | Species | Acoraceae | Eukaryota | TM-MC* | |||
NPO7317 | Citrus aurantium | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO32 | Peucedanidecursivi radix | NA | NA | NA | TCMSP* | |||
NPO26351 | Agastache rugosa | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO27288 | Citrus maxima | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO12028 | Acori tataninowii rhizoma | NA | NA | NA | TCMSP* | |||
NPO18007 | Agrimonia pilosa | Species | Rosaceae | Eukaryota | TM-MC* | |||
NPO25443 | Citrus reticulata | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO4368 | Magnolia officinalis | Species | Magnoliaceae | Eukaryota | TM-MC* | |||
NPO29579 | Arisaematis rhizoma | NA | NA | NA | TCMSP* | |||
NPO19649 | Akebia quinata | Species | Lardizabalaceae | Eukaryota | TM-MC* | |||
NPO10082 | Citrus unshiu | Species | Rutaceae | Eukaryota | TM-MC* | |||
NPO18932 | Melia azedarach | Species | Meliaceae | Eukaryota | TM-MC* | |||
NPO18932.1 | Melia azedarach var. toosendan | Varieties | Meliaceae | Eukaryota | TM-MC* | |||
NPO29723 | Solidaginis herba | NA | NA | NA | TCMSP* | |||
NPO22741 | Curcuma kwangsiensis | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO24124 | Curcuma longa | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO23256 | Mentha arvensis | Species | Lamiaceae | Eukaryota | TM-MC* | |||
NPO8455 | Magnolia officinalis rehd et wils | Species | Magnoliaceae | Eukaryota | TCMSP* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 2.8 | ug/ml | 17845001 |
NPT91 | Cell Line | KB | Homo sapiens | IC50 | > | 5 | ug/ml | 17845001 |
NPT2 | Others | Unspecified | IC50 | > | 5 | ug/ml | 17845001 | |
NPT639 | Cell Line | NCI-H187 | Homo sapiens | IC50 | = | 19.5 | ug/ml | 17845001 |
NPT762 | Cell Line | A-431 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT2 | Others | Unspecified | ED50 | > | 20 | ug/ml | 1517737 | |
NPT1851 | Cell Line | Col2 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT453 | Cell Line | HT-1080 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT168 | Cell Line | P388 | Mus musculus | ED50 | > | 20 | ug/ml | 1517737 |
NPT133 | Cell Line | ZR-75-1 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT1034 | Cell Line | Lu1 | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT858 | Cell Line | LNCaP | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT91 | Cell Line | KB | Homo sapiens | ED50 | > | 20 | ug/ml | 1517737 |
NPT32 | Organism | Mus musculus | Mus musculus | Activity | = | 2.13 | micromol/min | 1402962 |
NPT32 | Organism | Mus musculus | Mus musculus | Activity | = | 1.2 | micromol/min | 1402962 |
NPT32 | Organism | Mus musculus | Mus musculus | Activity | = | 0.59 | micromol/min | 1402962 |
NPT32 | Organism | Mus musculus | Mus musculus | Ratio | = | 2.88 | 1402962 | |
NPT32 | Organism | Mus musculus | Mus musculus | Ratio | = | 4.8 | 1402962 | |
NPT32 | Organism | Mus musculus | Mus musculus | Ratio | = | 0.95 | 1402962 | |
NPT67 | Individual Protein | Cholinesterase | Equus caballus | IC50 | = | 208400 | nM | 17067156 |
NPT485 | Organism | Plasmodium falciparum (isolate K1 / Thailand) | Plasmodium falciparum K1 | IC50 | > | 25000 | nM | 21438586 |
NPT844 | Organism | Trypanosoma brucei rhodesiense | Trypanosoma brucei rhodesiense | IC50 | > | 90000 | nM | 21438586 |
NPT839 | Cell Line | L6 | Rattus norvegicus | IC50 | > | 90000 | nM | 21438586 |
NPT66 | Individual Protein | Acetylcholinesterase | Electrophorus electricus | Inhibition | = | -12.83 | % | 23062825 |
NPT67 | Individual Protein | Cholinesterase | Equus caballus | Inhibition | = | 1.64 | % | 23062825 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
●  The left chart: Distribution of similarity level between NPC101285 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Natural Product ID |
---|---|---|
1.0 | High Similarity | NPC27853 |
1.0 | High Similarity | NPC65786 |
1.0 | High Similarity | NPC7491 |
1.0 | High Similarity | NPC13789 |
0.8548 | High Similarity | NPC33583 |
0.8548 | High Similarity | NPC161612 |
0.85 | High Similarity | NPC50435 |
0.807 | Intermediate Similarity | NPC286752 |
0.791 | Intermediate Similarity | NPC329763 |
0.7797 | Intermediate Similarity | NPC210316 |
0.7778 | Intermediate Similarity | NPC287744 |
0.7778 | Intermediate Similarity | NPC140233 |
0.7681 | Intermediate Similarity | NPC474419 |
0.7627 | Intermediate Similarity | NPC223604 |
0.7586 | Intermediate Similarity | NPC165755 |
0.7246 | Intermediate Similarity | NPC40327 |
0.7077 | Intermediate Similarity | NPC474155 |
0.7077 | Intermediate Similarity | NPC473759 |
0.7049 | Intermediate Similarity | NPC300189 |
0.7015 | Intermediate Similarity | NPC469328 |
0.6974 | Remote Similarity | NPC145963 |
0.6923 | Remote Similarity | NPC253204 |
0.6901 | Remote Similarity | NPC92909 |
0.6901 | Remote Similarity | NPC107783 |
0.6818 | Remote Similarity | NPC283247 |
0.6806 | Remote Similarity | NPC167049 |
0.6806 | Remote Similarity | NPC469691 |
0.678 | Remote Similarity | NPC142103 |
0.6769 | Remote Similarity | NPC40206 |
0.6769 | Remote Similarity | NPC162109 |
0.6765 | Remote Similarity | NPC473929 |
0.6765 | Remote Similarity | NPC475897 |
0.6765 | Remote Similarity | NPC327815 |
0.6719 | Remote Similarity | NPC240206 |
0.6716 | Remote Similarity | NPC219940 |
0.6716 | Remote Similarity | NPC101128 |
0.6712 | Remote Similarity | NPC475771 |
0.6712 | Remote Similarity | NPC469669 |
0.6712 | Remote Similarity | NPC469678 |
0.6712 | Remote Similarity | NPC475861 |
0.6667 | Remote Similarity | NPC474477 |
0.6667 | Remote Similarity | NPC251335 |
0.6667 | Remote Similarity | NPC15152 |
0.6667 | Remote Similarity | NPC228574 |
0.6667 | Remote Similarity | NPC87439 |
0.6667 | Remote Similarity | NPC39068 |
0.6667 | Remote Similarity | NPC294304 |
0.6667 | Remote Similarity | NPC264779 |
0.6622 | Remote Similarity | NPC226242 |
0.6622 | Remote Similarity | NPC476607 |
0.6618 | Remote Similarity | NPC61503 |
0.6615 | Remote Similarity | NPC83838 |
0.6615 | Remote Similarity | NPC184049 |
0.6615 | Remote Similarity | NPC143810 |
0.6615 | Remote Similarity | NPC99480 |
0.6533 | Remote Similarity | NPC186109 |
0.6533 | Remote Similarity | NPC471454 |
0.6515 | Remote Similarity | NPC127824 |
0.6508 | Remote Similarity | NPC67508 |
0.6508 | Remote Similarity | NPC84824 |
0.6479 | Remote Similarity | NPC329656 |
0.6479 | Remote Similarity | NPC239373 |
0.6479 | Remote Similarity | NPC74722 |
0.6479 | Remote Similarity | NPC329989 |
0.6479 | Remote Similarity | NPC304690 |
0.6479 | Remote Similarity | NPC22301 |
0.6479 | Remote Similarity | NPC474248 |
0.6471 | Remote Similarity | NPC68656 |
0.6471 | Remote Similarity | NPC144650 |
0.6471 | Remote Similarity | NPC309300 |
0.6471 | Remote Similarity | NPC225415 |
0.6462 | Remote Similarity | NPC474769 |
0.6462 | Remote Similarity | NPC189290 |
0.6452 | Remote Similarity | NPC161473 |
0.6447 | Remote Similarity | NPC474005 |
0.6447 | Remote Similarity | NPC207186 |
0.6438 | Remote Similarity | NPC470237 |
0.6438 | Remote Similarity | NPC476709 |
0.6429 | Remote Similarity | NPC269077 |
0.6429 | Remote Similarity | NPC185874 |
0.6429 | Remote Similarity | NPC139207 |
0.6429 | Remote Similarity | NPC253303 |
0.6429 | Remote Similarity | NPC259299 |
0.6406 | Remote Similarity | NPC24443 |
0.64 | Remote Similarity | NPC472472 |
0.64 | Remote Similarity | NPC268111 |
0.6393 | Remote Similarity | NPC474331 |
0.6377 | Remote Similarity | NPC172613 |
0.6377 | Remote Similarity | NPC60837 |
0.6377 | Remote Similarity | NPC238352 |
0.6377 | Remote Similarity | NPC477009 |
0.6377 | Remote Similarity | NPC2728 |
0.6377 | Remote Similarity | NPC474768 |
0.6377 | Remote Similarity | NPC208198 |
0.6377 | Remote Similarity | NPC282619 |
0.6377 | Remote Similarity | NPC11555 |
0.6377 | Remote Similarity | NPC300442 |
0.6377 | Remote Similarity | NPC258595 |
0.6364 | Remote Similarity | NPC5698 |
0.6351 | Remote Similarity | NPC190859 |
0.6351 | Remote Similarity | NPC71152 |
0.6338 | Remote Similarity | NPC245795 |
0.6338 | Remote Similarity | NPC276616 |
0.6338 | Remote Similarity | NPC305698 |
0.6338 | Remote Similarity | NPC244790 |
0.6286 | Remote Similarity | NPC476406 |
0.6282 | Remote Similarity | NPC304795 |
0.6282 | Remote Similarity | NPC475946 |
0.6269 | Remote Similarity | NPC135648 |
0.6269 | Remote Similarity | NPC323153 |
0.6267 | Remote Similarity | NPC93213 |
0.6267 | Remote Similarity | NPC113639 |
0.625 | Remote Similarity | NPC477448 |
0.625 | Remote Similarity | NPC477449 |
0.625 | Remote Similarity | NPC9942 |
0.625 | Remote Similarity | NPC269841 |
0.6234 | Remote Similarity | NPC475980 |
0.6234 | Remote Similarity | NPC474056 |
0.6232 | Remote Similarity | NPC107540 |
0.6232 | Remote Similarity | NPC469723 |
0.6232 | Remote Similarity | NPC290367 |
0.6232 | Remote Similarity | NPC300593 |
0.6212 | Remote Similarity | NPC475830 |
0.6212 | Remote Similarity | NPC10017 |
0.6203 | Remote Similarity | NPC478262 |
0.6203 | Remote Similarity | NPC472471 |
0.6197 | Remote Similarity | NPC469868 |
0.6197 | Remote Similarity | NPC477791 |
0.6197 | Remote Similarity | NPC74885 |
0.6197 | Remote Similarity | NPC308522 |
0.6197 | Remote Similarity | NPC136813 |
0.6197 | Remote Similarity | NPC171225 |
0.6184 | Remote Similarity | NPC310643 |
0.6184 | Remote Similarity | NPC471726 |
0.6184 | Remote Similarity | NPC474527 |
0.6184 | Remote Similarity | NPC470766 |
0.6184 | Remote Similarity | NPC170148 |
0.6176 | Remote Similarity | NPC41160 |
0.6176 | Remote Similarity | NPC147524 |
0.6176 | Remote Similarity | NPC225342 |
0.6176 | Remote Similarity | NPC475251 |
0.6167 | Remote Similarity | NPC100445 |
0.6164 | Remote Similarity | NPC283316 |
0.6164 | Remote Similarity | NPC133873 |
0.6164 | Remote Similarity | NPC475310 |
0.6154 | Remote Similarity | NPC325869 |
0.6154 | Remote Similarity | NPC179024 |
0.6143 | Remote Similarity | NPC19569 |
0.6143 | Remote Similarity | NPC471200 |
0.6133 | Remote Similarity | NPC475517 |
0.6133 | Remote Similarity | NPC471525 |
0.6133 | Remote Similarity | NPC227814 |
0.6133 | Remote Similarity | NPC474524 |
0.6133 | Remote Similarity | NPC144995 |
0.6125 | Remote Similarity | NPC471159 |
0.6125 | Remote Similarity | NPC475936 |
0.6125 | Remote Similarity | NPC123880 |
0.6111 | Remote Similarity | NPC476945 |
0.6111 | Remote Similarity | NPC96484 |
0.6111 | Remote Similarity | NPC208999 |
0.6111 | Remote Similarity | NPC139785 |
0.6111 | Remote Similarity | NPC167527 |
0.6104 | Remote Similarity | NPC476703 |
0.6104 | Remote Similarity | NPC283619 |
0.6104 | Remote Similarity | NPC470750 |
0.6104 | Remote Similarity | NPC470751 |
0.6104 | Remote Similarity | NPC211279 |
0.6087 | Remote Similarity | NPC133368 |
0.6087 | Remote Similarity | NPC211291 |
0.6081 | Remote Similarity | NPC471662 |
0.6081 | Remote Similarity | NPC167706 |
0.6081 | Remote Similarity | NPC477084 |
0.6081 | Remote Similarity | NPC164022 |
0.6076 | Remote Similarity | NPC472470 |
0.6071 | Remote Similarity | NPC78551 |
0.6071 | Remote Similarity | NPC227632 |
0.6071 | Remote Similarity | NPC62086 |
0.6061 | Remote Similarity | NPC278550 |
0.6056 | Remote Similarity | NPC267027 |
0.6053 | Remote Similarity | NPC12696 |
0.6053 | Remote Similarity | NPC36479 |
0.6049 | Remote Similarity | NPC475842 |
0.6049 | Remote Similarity | NPC53867 |
0.6049 | Remote Similarity | NPC260852 |
0.6049 | Remote Similarity | NPC475622 |
0.6049 | Remote Similarity | NPC108045 |
0.6034 | Remote Similarity | NPC109813 |
0.6034 | Remote Similarity | NPC60556 |
0.6034 | Remote Similarity | NPC15162 |
0.6032 | Remote Similarity | NPC306195 |
0.6032 | Remote Similarity | NPC157781 |
0.6032 | Remote Similarity | NPC35519 |
0.6032 | Remote Similarity | NPC179169 |
0.6032 | Remote Similarity | NPC181255 |
0.6029 | Remote Similarity | NPC475412 |
0.6029 | Remote Similarity | NPC66020 |
0.6029 | Remote Similarity | NPC252809 |
0.6027 | Remote Similarity | NPC261398 |
0.6027 | Remote Similarity | NPC471560 |
0.6027 | Remote Similarity | NPC5714 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC101285 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Drug ID | Developmental Stage |
---|---|---|---|
0.661 | Remote Similarity | NPD9410 | Clinical (unspecified phase) |
0.6515 | Remote Similarity | NPD1145 | Discontinued |
0.6143 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD6924 | Approved |
0.5921 | Remote Similarity | NPD6926 | Approved |
0.5769 | Remote Similarity | NPD6933 | Approved |
0.5763 | Remote Similarity | NPD367 | Approved |
0.5714 | Remote Similarity | NPD368 | Approved |
0.5663 | Remote Similarity | NPD6695 | Phase 3 |
0.5641 | Remote Similarity | NPD7339 | Approved |
0.5641 | Remote Similarity | NPD6942 | Approved |
0.56 | Remote Similarity | NPD6922 | Approved |
0.56 | Remote Similarity | NPD6923 | Approved |
PubChem CID   | 1742211 |
ChEMBL   | CHEMBL399036 |
ZINC   |
Molecular Weight:   | 220.18 |
ALogP:   | 1.9144 |
MLogP:   | 3 |
XLogP:   | 4.607 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 12.53 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 16 |