Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO18488 | Streptomyces griseolus | Species | Streptomycetaceae | Bacteria | UNPD* | |||
NPO22902 | Alnus alnobetula | Species | Betulaceae | Eukaryota | UNPD* | |||
NPO17562 | Phyllidiella pustulosa | Species | Phyllidiidae | Eukaryota | UNPD* | |||
NPO18822 | Dacrydium intermedium | Species | Mytilidae | Eukaryota | UNPD* | |||
NPO17045 | Argyreia speciosa | Species | Convolvulaceae | Eukaryota | UNPD* | |||
NPO16030 | Lecanora coniza | Species | Lecanoraceae | Eukaryota | UNPD* | |||
NPO16705 | Krameria parvifolia | Species | Krameriaceae | Eukaryota | UNPD* | |||
NPO19412 | Capsella bursa | Species | Donacidae | Eukaryota | UNPD* | |||
NPO17863 | Artocarpus styracifolius | Species | Moraceae | Eukaryota | UNPD* | |||
NPO19487 | Dorstenia mannii | Species | Moraceae | Eukaryota | UNPD* | |||
NPO3330 | Capsellae herba | NA | NA | NA | TCMSP* | |||
NPO28985 | Radix bupleuri | Species | Lymnaeidae | Eukaryota | TCMSP* | |||
NPO19064 | Forsythia giraldiana | Species | Oleaceae | Eukaryota | UNPD* | |||
NPO17431 | Vernonia profuga | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO19220 | Laurencia nidifica | Species | Rhodomelaceae | Eukaryota | UNPD* | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | DOI[10.1038/nbt.2488] | |||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[22411374] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | cerebrospinal fluid |
PMID[7710082] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | urine |
PMID[14988808] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | blood |
PMID[14988808] |
||
NPO21027 | Daphnia magna | Species | Daphniidae | Eukaryota |
PMID[20117838] |
|||
NPO18896 | Swertia chinensis | Species | Gentianaceae | Eukaryota | UNPD* | |||
NPO16900 | Aesculus turbinata | Species | Hippocastanaceae | Eukaryota | UNPD* | |||
NPO22561 | Dickeya chrysanthemi | Species | Pectobacteriaceae | Bacteria | UNPD* | |||
NPO7317 | Citrus aurantium | Species | Rutaceae | Eukaryota | UNPD* | |||
NPO13651 | Chondodendron toxicoferum | NA | NA | NA | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT72 | Individual Protein | Solute carrier organic anion transporter family member 1B3 | Homo sapiens | Inhibition | = | 94.42 | % | 23571415 |
NPT73 | Individual Protein | Solute carrier organic anion transporter family member 1B1 | Homo sapiens | Inhibition | = | 81.13 | % | 23571415 |
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 NPC182541 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 | NPC127074 |
1.0 | High Similarity | NPC197207 |
1.0 | High Similarity | NPC187058 |
1.0 | High Similarity | NPC149070 |
0.9062 | High Similarity | NPC66052 |
0.9062 | High Similarity | NPC86412 |
0.9062 | High Similarity | NPC293908 |
0.9062 | High Similarity | NPC192065 |
0.9062 | High Similarity | NPC325034 |
0.8966 | High Similarity | NPC33415 |
0.8966 | High Similarity | NPC301586 |
0.8621 | High Similarity | NPC320326 |
0.7838 | Intermediate Similarity | NPC227707 |
0.7838 | Intermediate Similarity | NPC266553 |
0.7838 | Intermediate Similarity | NPC111882 |
0.7838 | Intermediate Similarity | NPC88278 |
0.7838 | Intermediate Similarity | NPC102981 |
0.7838 | Intermediate Similarity | NPC99573 |
0.7647 | Intermediate Similarity | NPC227267 |
0.7586 | Intermediate Similarity | NPC157340 |
0.7586 | Intermediate Similarity | NPC199270 |
0.7436 | Intermediate Similarity | NPC298699 |
0.7436 | Intermediate Similarity | NPC228782 |
0.7436 | Intermediate Similarity | NPC313565 |
0.7436 | Intermediate Similarity | NPC213159 |
0.7436 | Intermediate Similarity | NPC86191 |
0.7436 | Intermediate Similarity | NPC320189 |
0.7436 | Intermediate Similarity | NPC134252 |
0.7436 | Intermediate Similarity | NPC291502 |
0.7436 | Intermediate Similarity | NPC259982 |
0.7436 | Intermediate Similarity | NPC317182 |
0.7333 | Intermediate Similarity | NPC140389 |
0.7333 | Intermediate Similarity | NPC88887 |
0.725 | Intermediate Similarity | NPC29721 |
0.725 | Intermediate Similarity | NPC320240 |
0.725 | Intermediate Similarity | NPC70756 |
0.7097 | Intermediate Similarity | NPC252154 |
0.7097 | Intermediate Similarity | NPC560 |
0.7073 | Intermediate Similarity | NPC207656 |
0.7073 | Intermediate Similarity | NPC107091 |
0.7 | Intermediate Similarity | NPC114270 |
0.7 | Intermediate Similarity | NPC245688 |
0.6905 | Remote Similarity | NPC255377 |
0.6905 | Remote Similarity | NPC176017 |
0.6905 | Remote Similarity | NPC73906 |
0.6905 | Remote Similarity | NPC92246 |
0.6905 | Remote Similarity | NPC289758 |
0.6905 | Remote Similarity | NPC285364 |
0.6905 | Remote Similarity | NPC199857 |
0.6905 | Remote Similarity | NPC21209 |
0.6905 | Remote Similarity | NPC69445 |
0.6905 | Remote Similarity | NPC165846 |
0.6897 | Remote Similarity | NPC219266 |
0.6774 | Remote Similarity | NPC232554 |
0.6774 | Remote Similarity | NPC213764 |
0.6744 | Remote Similarity | NPC252918 |
0.6744 | Remote Similarity | NPC277475 |
0.6744 | Remote Similarity | NPC314613 |
0.6744 | Remote Similarity | NPC321087 |
0.6744 | Remote Similarity | NPC88638 |
0.6744 | Remote Similarity | NPC230789 |
0.6667 | Remote Similarity | NPC242655 |
0.6667 | Remote Similarity | NPC52403 |
0.6667 | Remote Similarity | NPC270088 |
0.6667 | Remote Similarity | NPC38891 |
0.6667 | Remote Similarity | NPC325345 |
0.6667 | Remote Similarity | NPC39977 |
0.6667 | Remote Similarity | NPC159845 |
0.6591 | Remote Similarity | NPC172086 |
0.6591 | Remote Similarity | NPC247546 |
0.6591 | Remote Similarity | NPC112363 |
0.6591 | Remote Similarity | NPC14144 |
0.6571 | Remote Similarity | NPC321170 |
0.6571 | Remote Similarity | NPC266566 |
0.6571 | Remote Similarity | NPC31433 |
0.65 | Remote Similarity | NPC320331 |
0.6471 | Remote Similarity | NPC110884 |
0.6444 | Remote Similarity | NPC325822 |
0.6444 | Remote Similarity | NPC82512 |
0.6444 | Remote Similarity | NPC42503 |
0.6444 | Remote Similarity | NPC61270 |
0.6444 | Remote Similarity | NPC299781 |
0.6444 | Remote Similarity | NPC157193 |
0.6444 | Remote Similarity | NPC282143 |
0.6364 | Remote Similarity | NPC272307 |
0.6341 | Remote Similarity | NPC35661 |
0.6333 | Remote Similarity | NPC299484 |
0.6304 | Remote Similarity | NPC322158 |
0.6304 | Remote Similarity | NPC329128 |
0.6304 | Remote Similarity | NPC323574 |
0.6279 | Remote Similarity | NPC62014 |
0.625 | Remote Similarity | NPC275462 |
0.6207 | Remote Similarity | NPC236761 |
0.617 | Remote Similarity | NPC233726 |
0.617 | Remote Similarity | NPC23134 |
0.617 | Remote Similarity | NPC326533 |
0.617 | Remote Similarity | NPC124963 |
0.617 | Remote Similarity | NPC329095 |
0.6111 | Remote Similarity | NPC267243 |
0.6111 | Remote Similarity | NPC122962 |
0.6111 | Remote Similarity | NPC317060 |
0.6087 | Remote Similarity | NPC46254 |
0.6061 | Remote Similarity | NPC128335 |
0.6042 | Remote Similarity | NPC277878 |
0.6042 | Remote Similarity | NPC320043 |
0.6042 | Remote Similarity | NPC103672 |
0.6042 | Remote Similarity | NPC321102 |
0.6042 | Remote Similarity | NPC322803 |
0.6042 | Remote Similarity | NPC278465 |
0.6042 | Remote Similarity | NPC325153 |
0.6 | Remote Similarity | NPC294703 |
0.5952 | Remote Similarity | NPC100742 |
0.5952 | Remote Similarity | NPC121018 |
0.5952 | Remote Similarity | NPC192402 |
0.5952 | Remote Similarity | NPC19044 |
0.5952 | Remote Similarity | NPC97444 |
0.5952 | Remote Similarity | NPC24751 |
0.5946 | Remote Similarity | NPC193062 |
0.5946 | Remote Similarity | NPC72324 |
0.5946 | Remote Similarity | NPC319034 |
0.5946 | Remote Similarity | NPC66124 |
0.5946 | Remote Similarity | NPC1748 |
0.5938 | Remote Similarity | NPC87529 |
0.5938 | Remote Similarity | NPC94144 |
0.5918 | Remote Similarity | NPC145112 |
0.5918 | Remote Similarity | NPC242073 |
0.5918 | Remote Similarity | NPC323361 |
0.5918 | Remote Similarity | NPC317626 |
0.5918 | Remote Similarity | NPC67660 |
0.5918 | Remote Similarity | NPC269166 |
0.5918 | Remote Similarity | NPC130683 |
0.5918 | Remote Similarity | NPC246558 |
0.5918 | Remote Similarity | NPC19676 |
0.5918 | Remote Similarity | NPC89145 |
0.5918 | Remote Similarity | NPC314821 |
0.5918 | Remote Similarity | NPC107914 |
0.5918 | Remote Similarity | NPC317501 |
0.5918 | Remote Similarity | NPC323401 |
0.5918 | Remote Similarity | NPC165198 |
0.5918 | Remote Similarity | NPC157514 |
0.5918 | Remote Similarity | NPC196612 |
0.5918 | Remote Similarity | NPC58629 |
0.5897 | Remote Similarity | NPC474914 |
0.5897 | Remote Similarity | NPC313405 |
0.5897 | Remote Similarity | NPC474392 |
0.5897 | Remote Similarity | NPC5505 |
0.5882 | Remote Similarity | NPC39869 |
0.5882 | Remote Similarity | NPC276332 |
0.5833 | Remote Similarity | NPC200772 |
0.58 | Remote Similarity | NPC6883 |
0.58 | Remote Similarity | NPC303727 |
0.58 | Remote Similarity | NPC327257 |
0.5758 | Remote Similarity | NPC304786 |
0.5758 | Remote Similarity | NPC190797 |
0.5714 | Remote Similarity | NPC300235 |
0.5714 | Remote Similarity | NPC52362 |
0.5714 | Remote Similarity | NPC476149 |
0.5714 | Remote Similarity | NPC244869 |
0.5714 | Remote Similarity | NPC238135 |
0.5714 | Remote Similarity | NPC476136 |
0.5714 | Remote Similarity | NPC279895 |
0.5682 | Remote Similarity | NPC319680 |
0.5667 | Remote Similarity | NPC163707 |
0.5652 | Remote Similarity | NPC8597 |
0.5641 | Remote Similarity | NPC168052 |
0.5641 | Remote Similarity | NPC97967 |
0.5641 | Remote Similarity | NPC191084 |
0.5641 | Remote Similarity | NPC250870 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC182541 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 |
---|---|---|---|
1.0 | High Similarity | NPD8814 | Phase 3 |
0.9062 | High Similarity | NPD9052 | Approved |
0.9062 | High Similarity | NPD9051 | Approved |
0.9062 | High Similarity | NPD9053 | Approved |
0.8966 | High Similarity | NPD8549 | Clinical (unspecified phase) |
0.7838 | Intermediate Similarity | NPD8995 | Clinical (unspecified phase) |
0.7838 | Intermediate Similarity | NPD8996 | Phase 3 |
0.7778 | Intermediate Similarity | NPD8977 | Phase 3 |
0.7778 | Intermediate Similarity | NPD8976 | Approved |
0.7586 | Intermediate Similarity | NPD8226 | Approved |
0.7436 | Intermediate Similarity | NPD8958 | Phase 2 |
0.7436 | Intermediate Similarity | NPD8788 | Approved |
0.7436 | Intermediate Similarity | NPD8957 | Approved |
0.725 | Intermediate Similarity | NPD9006 | Approved |
0.7073 | Intermediate Similarity | NPD9219 | Approved |
0.7073 | Intermediate Similarity | NPD9218 | Clinical (unspecified phase) |
0.7 | Intermediate Similarity | NPD8225 | Phase 3 |
0.6905 | Remote Similarity | NPD8994 | Approved |
0.6905 | Remote Similarity | NPD8997 | Approved |
0.6905 | Remote Similarity | NPD8998 | Phase 2 |
0.6905 | Remote Similarity | NPD8993 | Phase 1 |
0.6905 | Remote Similarity | NPD9000 | Phase 3 |
0.6905 | Remote Similarity | NPD8999 | Phase 3 |
0.6667 | Remote Similarity | NPD9056 | Approved |
0.6667 | Remote Similarity | NPD8988 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD9055 | Approved |
0.6591 | Remote Similarity | NPD8966 | Approved |
0.6591 | Remote Similarity | NPD9003 | Clinical (unspecified phase) |
0.6591 | Remote Similarity | NPD9139 | Approved |
0.6591 | Remote Similarity | NPD9005 | Phase 3 |
0.6591 | Remote Similarity | NPD9004 | Approved |
0.6591 | Remote Similarity | NPD8965 | Approved |
0.6571 | Remote Similarity | NPD8237 | Approved |
0.6444 | Remote Similarity | NPD9061 | Clinical (unspecified phase) |
0.6286 | Remote Similarity | NPD8235 | Approved |
0.6286 | Remote Similarity | NPD8236 | Phase 1 |
0.6286 | Remote Similarity | NPD8234 | Approved |
0.617 | Remote Similarity | NPD904 | Phase 3 |
0.617 | Remote Similarity | NPD905 | Approved |
0.617 | Remote Similarity | NPD9002 | Approved |
0.617 | Remote Similarity | NPD9001 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD9669 | Clinical (unspecified phase) |
0.6087 | Remote Similarity | NPD8964 | Approved |
0.6042 | Remote Similarity | NPD65 | Approved |
0.6042 | Remote Similarity | NPD8960 | Approved |
0.6042 | Remote Similarity | NPD64 | Approved |
0.6042 | Remote Similarity | NPD9008 | Approved |
0.6042 | Remote Similarity | NPD9009 | Approved |
0.6042 | Remote Similarity | NPD9050 | Approved |
0.6042 | Remote Similarity | NPD9007 | Approved |
0.6042 | Remote Similarity | NPD9049 | Discontinued |
0.6042 | Remote Similarity | NPD72 | Approved |
0.6042 | Remote Similarity | NPD9010 | Approved |
0.6042 | Remote Similarity | NPD66 | Approved |
0.6042 | Remote Similarity | NPD9011 | Approved |
0.5952 | Remote Similarity | NPD8601 | Approved |
0.5952 | Remote Similarity | NPD8605 | Approved |
0.5952 | Remote Similarity | NPD8603 | Approved |
0.5952 | Remote Similarity | NPD8602 | Approved |
0.5952 | Remote Similarity | NPD8599 | Approved |
0.5952 | Remote Similarity | NPD8598 | Approved |
0.5952 | Remote Similarity | NPD8600 | Approved |
0.5952 | Remote Similarity | NPD8604 | Approved |
0.5918 | Remote Similarity | NPD893 | Approved |
0.5918 | Remote Similarity | NPD889 | Approved |
0.5918 | Remote Similarity | NPD888 | Phase 3 |
0.5918 | Remote Similarity | NPD9036 | Phase 3 |
0.5918 | Remote Similarity | NPD894 | Approved |
0.5918 | Remote Similarity | NPD892 | Phase 3 |
0.5918 | Remote Similarity | NPD890 | Clinical (unspecified phase) |
0.5918 | Remote Similarity | NPD887 | Approved |
0.5918 | Remote Similarity | NPD891 | Phase 3 |
0.5918 | Remote Similarity | NPD895 | Approved |
0.5918 | Remote Similarity | NPD9035 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD2269 | Approved |
0.5667 | Remote Similarity | NPD8224 | Approved |
PubChem CID   | |
ChEMBL   | CHEMBL3137744 |
ZINC   |
Molecular Weight:   | 152.07 |
ALogP:   | -2.4295 |
MLogP:   | 1.46 |
XLogP:   | -3.224 |
# Rotatable Bonds:   | 9 |
Polar Surface Area:   | 101.15 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 5 |
# Rings:   | 0 |
# Heavy Atoms:   | 10 |