Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO17126 | Callicarpa pilosissima | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO19194 | Licaria rigida | Species | Lauraceae | Eukaryota | UNPD* | |||
NPO36 | Kleinia articulata | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO10435 | Aphis serpylli | Species | Aphididae | Eukaryota | UNPD* | |||
NPO22955 | Ranunculus lanuginosus | Species | Ranunculaceae | Eukaryota | UNPD* | |||
NPO17981 | Melolontha vulgaris | Species | Scarabaeidae | Eukaryota | UNPD* | |||
NPO23289.1 | Heracleum sphondylium subsp. pyrenaicum | Subspecies | Apiaceae | Eukaryota | UNPD* | |||
NPO18452 | Haplophyton cimicidum | Species | Apocynaceae | Eukaryota | UNPD* | |||
NPO16824 | Cryptocarya oubatchensis | Species | Lauraceae | Eukaryota | UNPD* | |||
NPO8921 | Senna obtusifolia | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO19725 | Garcinia vilersiana | Species | Clusiaceae | Eukaryota | UNPD* | |||
NPO18943 | Dorstenia excentrica | Species | Moraceae | Eukaryota | UNPD* | |||
NPO19319 | Cedrelopsis grevei | Species | Rutaceae | Eukaryota | UNPD* | |||
NPO19529 | Astrotrichilia asterotricha | Species | Meliaceae | Eukaryota | UNPD* | |||
NPO1884 | Ptychodera flava | Species | Ptychoderidae | Eukaryota | UNPD* | |||
NPO2988 | Peteravenia schultzii | NA | NA | NA | UNPD* | |||
NPO14849 | Fritillaria unibracteata | Species | Liliaceae | Eukaryota | UNPD* | |||
NPO13440 | Enterolobium cyclocarpum | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO19255 | Necturus maculosus | Species | Proteidae | Eukaryota | UNPD* | |||
NPO19954 | Conogethes punctiferalis | Species | Crambidae | Eukaryota | UNPD* | |||
NPO22603 | Synedrellopsis grisebachii | NA | NA | NA | UNPD* | |||
NPO19452 | Gaillardia pinnatifida | Species | Asteraceae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT32 | Organism | Mus musculus | Mus musculus | LD50 | = | 4 | mg/kg | 3373229 |
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 NPC271632 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 |
---|---|---|
0.7654 | Intermediate Similarity | NPC301525 |
0.76 | Intermediate Similarity | NPC308457 |
0.75 | Intermediate Similarity | NPC220766 |
0.75 | Intermediate Similarity | NPC476589 |
0.7447 | Intermediate Similarity | NPC124181 |
0.7436 | Intermediate Similarity | NPC276290 |
0.7407 | Intermediate Similarity | NPC107654 |
0.7407 | Intermediate Similarity | NPC470686 |
0.7403 | Intermediate Similarity | NPC124586 |
0.7403 | Intermediate Similarity | NPC191233 |
0.7381 | Intermediate Similarity | NPC471537 |
0.7349 | Intermediate Similarity | NPC471225 |
0.7349 | Intermediate Similarity | NPC68156 |
0.7342 | Intermediate Similarity | NPC470693 |
0.734 | Intermediate Similarity | NPC153559 |
0.7333 | Intermediate Similarity | NPC15193 |
0.7284 | Intermediate Similarity | NPC222244 |
0.7284 | Intermediate Similarity | NPC287878 |
0.7284 | Intermediate Similarity | NPC16349 |
0.7263 | Intermediate Similarity | NPC473307 |
0.7253 | Intermediate Similarity | NPC51653 |
0.725 | Intermediate Similarity | NPC59558 |
0.725 | Intermediate Similarity | NPC315285 |
0.725 | Intermediate Similarity | NPC64234 |
0.725 | Intermediate Similarity | NPC37929 |
0.7237 | Intermediate Similarity | NPC217940 |
0.7215 | Intermediate Similarity | NPC238223 |
0.7209 | Intermediate Similarity | NPC474894 |
0.72 | Intermediate Similarity | NPC26223 |
0.7195 | Intermediate Similarity | NPC474758 |
0.7195 | Intermediate Similarity | NPC315843 |
0.7191 | Intermediate Similarity | NPC61527 |
0.716 | Intermediate Similarity | NPC316185 |
0.7143 | Intermediate Similarity | NPC315394 |
0.7143 | Intermediate Similarity | NPC148233 |
0.7143 | Intermediate Similarity | NPC25747 |
0.7143 | Intermediate Similarity | NPC473825 |
0.7128 | Intermediate Similarity | NPC241407 |
0.7128 | Intermediate Similarity | NPC291709 |
0.7126 | Intermediate Similarity | NPC10080 |
0.7126 | Intermediate Similarity | NPC123908 |
0.7125 | Intermediate Similarity | NPC88877 |
0.7125 | Intermediate Similarity | NPC232812 |
0.7125 | Intermediate Similarity | NPC476591 |
0.7125 | Intermediate Similarity | NPC329656 |
0.7097 | Intermediate Similarity | NPC282644 |
0.7097 | Intermediate Similarity | NPC29798 |
0.7089 | Intermediate Similarity | NPC203335 |
0.7089 | Intermediate Similarity | NPC194871 |
0.7089 | Intermediate Similarity | NPC132286 |
0.7083 | Intermediate Similarity | NPC90819 |
0.7059 | Intermediate Similarity | NPC474005 |
0.7051 | Intermediate Similarity | NPC471556 |
0.7051 | Intermediate Similarity | NPC182794 |
0.7045 | Intermediate Similarity | NPC44261 |
0.7037 | Intermediate Similarity | NPC315597 |
0.7037 | Intermediate Similarity | NPC329904 |
0.7037 | Intermediate Similarity | NPC469660 |
0.7037 | Intermediate Similarity | NPC473361 |
0.7011 | Intermediate Similarity | NPC141810 |
0.7 | Intermediate Similarity | NPC470256 |
0.7 | Intermediate Similarity | NPC291712 |
0.6988 | Remote Similarity | NPC476355 |
0.6988 | Remote Similarity | NPC140287 |
0.6977 | Remote Similarity | NPC473980 |
0.6977 | Remote Similarity | NPC473981 |
0.6977 | Remote Similarity | NPC471299 |
0.6966 | Remote Similarity | NPC78673 |
0.6966 | Remote Similarity | NPC160517 |
0.6966 | Remote Similarity | NPC186155 |
0.6962 | Remote Similarity | NPC315115 |
0.6957 | Remote Similarity | NPC64913 |
0.6957 | Remote Similarity | NPC242877 |
0.6951 | Remote Similarity | NPC133098 |
0.6951 | Remote Similarity | NPC477084 |
0.6941 | Remote Similarity | NPC474278 |
0.6941 | Remote Similarity | NPC97516 |
0.6939 | Remote Similarity | NPC219038 |
0.6932 | Remote Similarity | NPC474028 |
0.6932 | Remote Similarity | NPC474439 |
0.6932 | Remote Similarity | NPC475690 |
0.6923 | Remote Similarity | NPC266957 |
0.6914 | Remote Similarity | NPC151481 |
0.6897 | Remote Similarity | NPC474739 |
0.6889 | Remote Similarity | NPC281172 |
0.6889 | Remote Similarity | NPC130030 |
0.6882 | Remote Similarity | NPC475748 |
0.6875 | Remote Similarity | NPC472266 |
0.6875 | Remote Similarity | NPC21998 |
0.6869 | Remote Similarity | NPC471599 |
0.686 | Remote Similarity | NPC474816 |
0.686 | Remote Similarity | NPC475699 |
0.686 | Remote Similarity | NPC23187 |
0.686 | Remote Similarity | NPC209135 |
0.686 | Remote Similarity | NPC279532 |
0.6854 | Remote Similarity | NPC16488 |
0.6854 | Remote Similarity | NPC475714 |
0.6854 | Remote Similarity | NPC170377 |
0.6854 | Remote Similarity | NPC170286 |
0.6854 | Remote Similarity | NPC475947 |
0.6854 | Remote Similarity | NPC315559 |
0.6848 | Remote Similarity | NPC233997 |
0.6848 | Remote Similarity | NPC260343 |
0.6842 | Remote Similarity | NPC471147 |
0.6842 | Remote Similarity | NPC133600 |
0.6835 | Remote Similarity | NPC282760 |
0.6835 | Remote Similarity | NPC471565 |
0.6835 | Remote Similarity | NPC471566 |
0.6829 | Remote Similarity | NPC316029 |
0.6824 | Remote Similarity | NPC123360 |
0.6824 | Remote Similarity | NPC470705 |
0.6818 | Remote Similarity | NPC475481 |
0.6818 | Remote Similarity | NPC79277 |
0.6813 | Remote Similarity | NPC204048 |
0.6813 | Remote Similarity | NPC186332 |
0.6813 | Remote Similarity | NPC47220 |
0.6809 | Remote Similarity | NPC32552 |
0.6809 | Remote Similarity | NPC32494 |
0.6809 | Remote Similarity | NPC175842 |
0.6804 | Remote Similarity | NPC471490 |
0.6795 | Remote Similarity | NPC179087 |
0.6795 | Remote Similarity | NPC210303 |
0.6795 | Remote Similarity | NPC44343 |
0.679 | Remote Similarity | NPC475760 |
0.679 | Remote Similarity | NPC313444 |
0.679 | Remote Similarity | NPC477117 |
0.6786 | Remote Similarity | NPC474280 |
0.6782 | Remote Similarity | NPC99651 |
0.6782 | Remote Similarity | NPC270126 |
0.6782 | Remote Similarity | NPC617 |
0.6782 | Remote Similarity | NPC475210 |
0.6778 | Remote Similarity | NPC475706 |
0.6774 | Remote Similarity | NPC133450 |
0.6774 | Remote Similarity | NPC95364 |
0.6774 | Remote Similarity | NPC83423 |
0.6774 | Remote Similarity | NPC142159 |
0.6771 | Remote Similarity | NPC471492 |
0.6753 | Remote Similarity | NPC127824 |
0.6753 | Remote Similarity | NPC79756 |
0.6753 | Remote Similarity | NPC309408 |
0.675 | Remote Similarity | NPC248125 |
0.675 | Remote Similarity | NPC146811 |
0.6747 | Remote Similarity | NPC163003 |
0.6744 | Remote Similarity | NPC49302 |
0.6744 | Remote Similarity | NPC141789 |
0.6744 | Remote Similarity | NPC171204 |
0.6744 | Remote Similarity | NPC474818 |
0.6744 | Remote Similarity | NPC262747 |
0.6744 | Remote Similarity | NPC51809 |
0.6744 | Remote Similarity | NPC176329 |
0.6744 | Remote Similarity | NPC125365 |
0.6744 | Remote Similarity | NPC476028 |
0.6742 | Remote Similarity | NPC475936 |
0.6742 | Remote Similarity | NPC474252 |
0.6742 | Remote Similarity | NPC313677 |
0.6739 | Remote Similarity | NPC231889 |
0.6739 | Remote Similarity | NPC475087 |
0.6739 | Remote Similarity | NPC476600 |
0.6737 | Remote Similarity | NPC189651 |
0.6737 | Remote Similarity | NPC165383 |
0.6737 | Remote Similarity | NPC475098 |
0.6737 | Remote Similarity | NPC248193 |
0.6737 | Remote Similarity | NPC59646 |
0.6735 | Remote Similarity | NPC151093 |
0.6733 | Remote Similarity | NPC477510 |
0.6733 | Remote Similarity | NPC471143 |
0.6709 | Remote Similarity | NPC477457 |
0.6709 | Remote Similarity | NPC477456 |
0.6707 | Remote Similarity | NPC269841 |
0.6707 | Remote Similarity | NPC473603 |
0.6707 | Remote Similarity | NPC476059 |
0.6706 | Remote Similarity | NPC469414 |
0.6706 | Remote Similarity | NPC329826 |
0.6706 | Remote Similarity | NPC478194 |
0.6706 | Remote Similarity | NPC315552 |
0.6706 | Remote Similarity | NPC478192 |
0.6706 | Remote Similarity | NPC478191 |
0.6706 | Remote Similarity | NPC478193 |
0.6706 | Remote Similarity | NPC329852 |
0.6706 | Remote Similarity | NPC478195 |
0.6706 | Remote Similarity | NPC478196 |
0.6705 | Remote Similarity | NPC281132 |
0.6703 | Remote Similarity | NPC471223 |
0.6703 | Remote Similarity | NPC67081 |
0.6703 | Remote Similarity | NPC474424 |
0.6703 | Remote Similarity | NPC197903 |
0.6703 | Remote Similarity | NPC474547 |
0.6703 | Remote Similarity | NPC99395 |
0.6702 | Remote Similarity | NPC327253 |
0.6702 | Remote Similarity | NPC3436 |
0.6702 | Remote Similarity | NPC177668 |
0.6702 | Remote Similarity | NPC3952 |
0.6701 | Remote Similarity | NPC473333 |
0.6667 | Remote Similarity | NPC108045 |
0.6667 | Remote Similarity | NPC477512 |
0.6667 | Remote Similarity | NPC474193 |
0.6667 | Remote Similarity | NPC473471 |
0.6667 | Remote Similarity | NPC108816 |
0.6667 | Remote Similarity | NPC473658 |
0.6667 | Remote Similarity | NPC244878 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC271632 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 |
---|---|---|---|
0.7273 | Intermediate Similarity | NPD2685 | Clinical (unspecified phase) |
0.6882 | Remote Similarity | NPD7838 | Discovery |
0.6837 | Remote Similarity | NPD6648 | Approved |
0.6702 | Remote Similarity | NPD46 | Approved |
0.6702 | Remote Similarity | NPD6698 | Approved |
0.6593 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.6556 | Remote Similarity | NPD5209 | Approved |
0.6522 | Remote Similarity | NPD1733 | Clinical (unspecified phase) |
0.6436 | Remote Similarity | NPD5344 | Discontinued |
0.6296 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.6238 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6216 | Remote Similarity | NPD6927 | Phase 3 |
0.6136 | Remote Similarity | NPD8039 | Approved |
0.6129 | Remote Similarity | NPD7154 | Phase 3 |
0.6078 | Remote Similarity | NPD4225 | Approved |
0.6042 | Remote Similarity | NPD1282 | Approved |
0.5918 | Remote Similarity | NPD1695 | Approved |
0.5876 | Remote Similarity | NPD4251 | Approved |
0.5876 | Remote Similarity | NPD4250 | Approved |
0.5875 | Remote Similarity | NPD585 | Clinical (unspecified phase) |
0.5851 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.5824 | Remote Similarity | NPD4756 | Discovery |
0.5818 | Remote Similarity | NPD2067 | Discontinued |
0.5806 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.58 | Remote Similarity | NPD7983 | Approved |
0.58 | Remote Similarity | NPD7637 | Suspended |
0.5789 | Remote Similarity | NPD6110 | Phase 1 |
0.5789 | Remote Similarity | NPD7115 | Discovery |
0.5773 | Remote Similarity | NPD4249 | Approved |
0.575 | Remote Similarity | NPD8779 | Phase 3 |
0.5714 | Remote Similarity | NPD6053 | Discontinued |
0.5688 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.5676 | Remote Similarity | NPD6371 | Approved |
0.567 | Remote Similarity | NPD1694 | Approved |
0.567 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.5638 | Remote Similarity | NPD4819 | Approved |
0.5638 | Remote Similarity | NPD4820 | Approved |
0.5638 | Remote Similarity | NPD4821 | Approved |
0.5638 | Remote Similarity | NPD4822 | Approved |
0.5625 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD6051 | Approved |
PubChem CID   | 6437365 |
ChEMBL   | CHEMBL512656 |
ZINC   |
Molecular Weight:   | 416.22 |
ALogP:   | 2.5219 |
MLogP:   | 3.44 |
XLogP:   | 2.323 |
# Rotatable Bonds:   | 14 |
Polar Surface Area:   | 69.82 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 0 |
# Rings:   | 4 |
# Heavy Atoms:   | 30 |