Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO29010 | Amomum compactum | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO12322 | Amomum krervanh | Species | Zingiberaceae | Eukaryota | TM-MC* | |||
NPO11100 | Artemisia capillaris | Species | Asteraceae | Eukaryota | TM-MC* | |||
NPO28256 | Platycladus orientalis | Species | Cupressaceae | Eukaryota | TM-MC* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT483 | Individual Protein | Prelamin-A/C | Homo sapiens | Potency | = | 631 | nM | PubChem BioAssay data set |
NPT46 | Individual Protein | Thyroid hormone receptor beta-1 | Homo sapiens | Potency | = | 501.2 | nM | PubChem BioAssay data set |
NPT94 | Individual Protein | Aldehyde dehydrogenase 1A1 | Homo sapiens | Potency | = | 28183.8 | nM | PubChem BioAssay data set |
NPT792 | Individual Protein | Arachidonate 15-lipoxygenase | Homo sapiens | Potency | = | 31622.8 | nM | PubChem BioAssay data set |
NPT282 | Individual Protein | MAP kinase ERK2 | Homo sapiens | Potency | = | 1412.5 | nM | PubChem BioAssay data set |
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 NPC202146 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 | NPC32222 |
0.8545 | High Similarity | NPC3025 |
0.8421 | Intermediate Similarity | NPC95958 |
0.8136 | Intermediate Similarity | NPC95804 |
0.8136 | Intermediate Similarity | NPC185547 |
0.807 | Intermediate Similarity | NPC150713 |
0.807 | Intermediate Similarity | NPC29976 |
0.7931 | Intermediate Similarity | NPC162685 |
0.7885 | Intermediate Similarity | NPC14552 |
0.7719 | Intermediate Similarity | NPC178223 |
0.7719 | Intermediate Similarity | NPC89069 |
0.7719 | Intermediate Similarity | NPC277917 |
0.7719 | Intermediate Similarity | NPC166894 |
0.7719 | Intermediate Similarity | NPC283655 |
0.7705 | Intermediate Similarity | NPC209686 |
0.7705 | Intermediate Similarity | NPC249078 |
0.7705 | Intermediate Similarity | NPC236099 |
0.7679 | Intermediate Similarity | NPC36002 |
0.7679 | Intermediate Similarity | NPC102336 |
0.7593 | Intermediate Similarity | NPC127997 |
0.7593 | Intermediate Similarity | NPC95969 |
0.7593 | Intermediate Similarity | NPC316035 |
0.7544 | Intermediate Similarity | NPC53209 |
0.7541 | Intermediate Similarity | NPC148174 |
0.7541 | Intermediate Similarity | NPC147524 |
0.7541 | Intermediate Similarity | NPC218585 |
0.7541 | Intermediate Similarity | NPC71460 |
0.75 | Intermediate Similarity | NPC48079 |
0.746 | Intermediate Similarity | NPC474380 |
0.746 | Intermediate Similarity | NPC41577 |
0.746 | Intermediate Similarity | NPC473276 |
0.7458 | Intermediate Similarity | NPC236588 |
0.7458 | Intermediate Similarity | NPC135438 |
0.7419 | Intermediate Similarity | NPC114891 |
0.7414 | Intermediate Similarity | NPC471269 |
0.7385 | Intermediate Similarity | NPC472741 |
0.7385 | Intermediate Similarity | NPC474756 |
0.7377 | Intermediate Similarity | NPC84218 |
0.7358 | Intermediate Similarity | NPC77550 |
0.7358 | Intermediate Similarity | NPC108441 |
0.7344 | Intermediate Similarity | NPC142712 |
0.7333 | Intermediate Similarity | NPC476735 |
0.7302 | Intermediate Similarity | NPC69149 |
0.7302 | Intermediate Similarity | NPC128608 |
0.7273 | Intermediate Similarity | NPC241085 |
0.7273 | Intermediate Similarity | NPC107919 |
0.7273 | Intermediate Similarity | NPC299948 |
0.7273 | Intermediate Similarity | NPC294858 |
0.7273 | Intermediate Similarity | NPC470830 |
0.7273 | Intermediate Similarity | NPC66407 |
0.7273 | Intermediate Similarity | NPC129829 |
0.7273 | Intermediate Similarity | NPC254037 |
0.7231 | Intermediate Similarity | NPC74885 |
0.7231 | Intermediate Similarity | NPC63190 |
0.7231 | Intermediate Similarity | NPC308522 |
0.7231 | Intermediate Similarity | NPC473230 |
0.7231 | Intermediate Similarity | NPC475884 |
0.7188 | Intermediate Similarity | NPC472946 |
0.7188 | Intermediate Similarity | NPC475943 |
0.7188 | Intermediate Similarity | NPC190827 |
0.7188 | Intermediate Similarity | NPC243469 |
0.7164 | Intermediate Similarity | NPC282454 |
0.7164 | Intermediate Similarity | NPC192192 |
0.7164 | Intermediate Similarity | NPC231945 |
0.7077 | Intermediate Similarity | NPC44122 |
0.7059 | Intermediate Similarity | NPC195530 |
0.7059 | Intermediate Similarity | NPC1340 |
0.7059 | Intermediate Similarity | NPC157777 |
0.7059 | Intermediate Similarity | NPC473279 |
0.7059 | Intermediate Similarity | NPC470071 |
0.7059 | Intermediate Similarity | NPC157422 |
0.7059 | Intermediate Similarity | NPC100586 |
0.7059 | Intermediate Similarity | NPC8004 |
0.7059 | Intermediate Similarity | NPC127283 |
0.7059 | Intermediate Similarity | NPC109457 |
0.7059 | Intermediate Similarity | NPC187471 |
0.7059 | Intermediate Similarity | NPC131506 |
0.7059 | Intermediate Similarity | NPC252182 |
0.7059 | Intermediate Similarity | NPC127094 |
0.7049 | Intermediate Similarity | NPC189290 |
0.7049 | Intermediate Similarity | NPC474769 |
0.7031 | Intermediate Similarity | NPC159654 |
0.7031 | Intermediate Similarity | NPC118937 |
0.7031 | Intermediate Similarity | NPC167995 |
0.7031 | Intermediate Similarity | NPC219940 |
0.7031 | Intermediate Similarity | NPC281540 |
0.7015 | Intermediate Similarity | NPC196197 |
0.7015 | Intermediate Similarity | NPC477820 |
0.7 | Intermediate Similarity | NPC139765 |
0.7 | Intermediate Similarity | NPC91387 |
0.7 | Intermediate Similarity | NPC231680 |
0.7 | Intermediate Similarity | NPC39068 |
0.7 | Intermediate Similarity | NPC270306 |
0.7 | Intermediate Similarity | NPC264779 |
0.7 | Intermediate Similarity | NPC476424 |
0.7 | Intermediate Similarity | NPC131584 |
0.7 | Intermediate Similarity | NPC155441 |
0.6957 | Remote Similarity | NPC473238 |
0.6957 | Remote Similarity | NPC153719 |
0.6957 | Remote Similarity | NPC472341 |
0.6912 | Remote Similarity | NPC63588 |
0.6912 | Remote Similarity | NPC232925 |
0.6912 | Remote Similarity | NPC251201 |
0.6909 | Remote Similarity | NPC84030 |
0.6909 | Remote Similarity | NPC223468 |
0.6909 | Remote Similarity | NPC287550 |
0.6909 | Remote Similarity | NPC198540 |
0.6909 | Remote Similarity | NPC176309 |
0.6909 | Remote Similarity | NPC147343 |
0.6866 | Remote Similarity | NPC473225 |
0.6857 | Remote Similarity | NPC192501 |
0.6857 | Remote Similarity | NPC477508 |
0.6857 | Remote Similarity | NPC475458 |
0.6857 | Remote Similarity | NPC228994 |
0.6857 | Remote Similarity | NPC10476 |
0.6857 | Remote Similarity | NPC304499 |
0.6849 | Remote Similarity | NPC269333 |
0.6849 | Remote Similarity | NPC329871 |
0.6833 | Remote Similarity | NPC45387 |
0.6833 | Remote Similarity | NPC300189 |
0.6825 | Remote Similarity | NPC135648 |
0.6812 | Remote Similarity | NPC111234 |
0.6812 | Remote Similarity | NPC478103 |
0.6806 | Remote Similarity | NPC11907 |
0.6806 | Remote Similarity | NPC474574 |
0.6806 | Remote Similarity | NPC133596 |
0.6806 | Remote Similarity | NPC64081 |
0.6774 | Remote Similarity | NPC475515 |
0.6774 | Remote Similarity | NPC215671 |
0.6774 | Remote Similarity | NPC47663 |
0.6774 | Remote Similarity | NPC87296 |
0.6761 | Remote Similarity | NPC243027 |
0.6761 | Remote Similarity | NPC317242 |
0.6761 | Remote Similarity | NPC186851 |
0.6761 | Remote Similarity | NPC3403 |
0.6761 | Remote Similarity | NPC196136 |
0.6761 | Remote Similarity | NPC158208 |
0.6724 | Remote Similarity | NPC274182 |
0.6721 | Remote Similarity | NPC179024 |
0.6719 | Remote Similarity | NPC15152 |
0.6719 | Remote Similarity | NPC83088 |
0.6714 | Remote Similarity | NPC232112 |
0.6714 | Remote Similarity | NPC470610 |
0.6714 | Remote Similarity | NPC201373 |
0.6667 | Remote Similarity | NPC45296 |
0.6667 | Remote Similarity | NPC475728 |
0.6667 | Remote Similarity | NPC300442 |
0.6667 | Remote Similarity | NPC91573 |
0.6667 | Remote Similarity | NPC163597 |
0.6667 | Remote Similarity | NPC144891 |
0.6667 | Remote Similarity | NPC64123 |
0.6667 | Remote Similarity | NPC230047 |
0.6667 | Remote Similarity | NPC470145 |
0.6667 | Remote Similarity | NPC260116 |
0.6667 | Remote Similarity | NPC80463 |
0.6667 | Remote Similarity | NPC19311 |
0.6622 | Remote Similarity | NPC81074 |
0.6622 | Remote Similarity | NPC477282 |
0.662 | Remote Similarity | NPC192638 |
0.662 | Remote Similarity | NPC145552 |
0.662 | Remote Similarity | NPC48795 |
0.662 | Remote Similarity | NPC25511 |
0.662 | Remote Similarity | NPC254509 |
0.662 | Remote Similarity | NPC62657 |
0.662 | Remote Similarity | NPC49168 |
0.662 | Remote Similarity | NPC478130 |
0.662 | Remote Similarity | NPC5046 |
0.662 | Remote Similarity | NPC196358 |
0.6615 | Remote Similarity | NPC292419 |
0.6615 | Remote Similarity | NPC290791 |
0.6613 | Remote Similarity | NPC291147 |
0.66 | Remote Similarity | NPC328441 |
0.6575 | Remote Similarity | NPC23884 |
0.6575 | Remote Similarity | NPC212453 |
0.6575 | Remote Similarity | NPC185915 |
0.6575 | Remote Similarity | NPC128951 |
0.6575 | Remote Similarity | NPC192046 |
0.6575 | Remote Similarity | NPC477227 |
0.6575 | Remote Similarity | NPC475031 |
0.6575 | Remote Similarity | NPC476233 |
0.6575 | Remote Similarity | NPC105208 |
0.6575 | Remote Similarity | NPC302578 |
0.6571 | Remote Similarity | NPC320549 |
0.6571 | Remote Similarity | NPC58057 |
0.6571 | Remote Similarity | NPC156277 |
0.6571 | Remote Similarity | NPC89310 |
0.6571 | Remote Similarity | NPC151018 |
0.6567 | Remote Similarity | NPC42060 |
0.6567 | Remote Similarity | NPC477931 |
0.6567 | Remote Similarity | NPC268736 |
0.6545 | Remote Similarity | NPC313795 |
0.6533 | Remote Similarity | NPC66766 |
0.6533 | Remote Similarity | NPC117137 |
0.6528 | Remote Similarity | NPC178383 |
0.6528 | Remote Similarity | NPC118508 |
0.6528 | Remote Similarity | NPC212733 |
0.6528 | Remote Similarity | NPC97534 |
0.6528 | Remote Similarity | NPC195155 |
0.6528 | Remote Similarity | NPC174964 |
0.6528 | Remote Similarity | NPC121744 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC202146 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 |
---|---|---|---|
0.7358 | Intermediate Similarity | NPD386 | Approved |
0.7358 | Intermediate Similarity | NPD388 | Approved |
0.7273 | Intermediate Similarity | NPD4267 | Clinical (unspecified phase) |
0.7121 | Intermediate Similarity | NPD5361 | Clinical (unspecified phase) |
0.7121 | Intermediate Similarity | NPD5360 | Phase 3 |
0.6923 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.6912 | Remote Similarity | NPD4787 | Phase 1 |
0.6909 | Remote Similarity | NPD384 | Approved |
0.6909 | Remote Similarity | NPD385 | Approved |
0.6812 | Remote Similarity | NPD4758 | Discontinued |
0.6571 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.6571 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.6571 | Remote Similarity | NPD4243 | Approved |
0.6567 | Remote Similarity | NPD4224 | Phase 2 |
0.6522 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.6522 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.6438 | Remote Similarity | NPD6117 | Approved |
0.6429 | Remote Similarity | NPD4789 | Approved |
0.6389 | Remote Similarity | NPD4785 | Approved |
0.6389 | Remote Similarity | NPD4784 | Approved |
0.6389 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.6377 | Remote Similarity | NPD6705 | Phase 1 |
0.6364 | Remote Similarity | NPD367 | Approved |
0.6351 | Remote Similarity | NPD6116 | Phase 1 |
0.6338 | Remote Similarity | NPD6081 | Approved |
0.6316 | Remote Similarity | NPD7525 | Registered |
0.6301 | Remote Similarity | NPD3703 | Phase 2 |
0.6301 | Remote Similarity | NPD7339 | Approved |
0.6301 | Remote Similarity | NPD4190 | Phase 3 |
0.6301 | Remote Similarity | NPD5275 | Approved |
0.6301 | Remote Similarity | NPD6942 | Approved |
0.6301 | Remote Similarity | NPD3702 | Approved |
0.6286 | Remote Similarity | NPD3698 | Phase 2 |
0.6267 | Remote Similarity | NPD6118 | Approved |
0.6267 | Remote Similarity | NPD5364 | Discontinued |
0.6267 | Remote Similarity | NPD6697 | Approved |
0.6267 | Remote Similarity | NPD6114 | Approved |
0.6267 | Remote Similarity | NPD6115 | Approved |
0.6197 | Remote Similarity | NPD4244 | Approved |
0.6197 | Remote Similarity | NPD4245 | Approved |
0.619 | Remote Similarity | NPD586 | Phase 1 |
0.6104 | Remote Similarity | NPD6928 | Phase 2 |
0.6104 | Remote Similarity | NPD4748 | Discontinued |
0.6034 | Remote Similarity | NPD343 | Approved |
0.6034 | Remote Similarity | NPD345 | Approved |
0.6034 | Remote Similarity | NPD344 | Approved |
0.6 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5974 | Remote Similarity | NPD4195 | Approved |
0.5946 | Remote Similarity | NPD6924 | Approved |
0.5946 | Remote Similarity | NPD6926 | Approved |
0.5844 | Remote Similarity | NPD3671 | Phase 1 |
0.5823 | Remote Similarity | NPD4692 | Approved |
0.5823 | Remote Similarity | NPD4139 | Approved |
0.5797 | Remote Similarity | NPD371 | Approved |
0.5789 | Remote Similarity | NPD6933 | Approved |
0.575 | Remote Similarity | NPD4221 | Approved |
0.575 | Remote Similarity | NPD4223 | Phase 3 |
0.5732 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5679 | Remote Similarity | NPD4788 | Approved |
0.5676 | Remote Similarity | NPD7152 | Approved |
0.5676 | Remote Similarity | NPD7151 | Approved |
0.5676 | Remote Similarity | NPD7150 | Approved |
0.5641 | Remote Similarity | NPD3617 | Approved |
0.5625 | Remote Similarity | NPD615 | Clinical (unspecified phase) |
0.5616 | Remote Similarity | NPD6922 | Approved |
0.5616 | Remote Similarity | NPD6923 | Approved |
0.561 | Remote Similarity | NPD4197 | Approved |
0.561 | Remote Similarity | NPD4786 | Approved |
PubChem CID   | 6432709 |
ChEMBL   | CHEMBL1592444 |
ZINC   |
Molecular Weight:   | 222.20 |
ALogP:   | 1.3573 |
MLogP:   | 3 |
XLogP:   | 5.176 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 3 |
# Heavy Atoms:   | 16 |