Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO20456 | Chrysanthemum tatsienense | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO13628 | Rabdosia longituba | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO7875 | Pseudocyphellaria berberina | Species | Lobariaceae | Eukaryota | UNPD* | |||
NPO5308 | Stilpnopappus trichospiroides | NA | NA | NA | UNPD* | |||
NPO10933 | Stenanthera gabonensis | NA | NA | NA | UNPD* | |||
NPO15729 | Streptomyces karnatakensis | Species | Streptomycetaceae | Bacteria | UNPD* | |||
NPO14633 | Tridacna maxima | Species | Tridacnidae | Eukaryota | UNPD* | |||
NPO3508 | Aglaia tenuicaulis | Species | Meliaceae | Eukaryota | UNPD* | |||
NPO9160 | Plantago nivalis | Species | Plantaginaceae | Eukaryota | UNPD* | |||
NPO26654 | Penicillium citreonigrum | Species | Aspergillaceae | Eukaryota | Atlantic |
PMID[20450206] |
||
NPO16003 | Machaerium incorruptibile | Species | Dolichopodidae | Eukaryota | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT17 | Organism | Staphylococcus epidermidis | Staphylococcus epidermidis | IZ | = | 8 | mm | 20450206 |
NPT532 | Individual Protein | Lysine-specific demethylase 4A | Homo sapiens | Potency | 79432.8 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 20596.2 | nM | PubChem BioAssay data set | ||
NPT443 | Individual Protein | Histone acetyltransferase GCN5 | Homo sapiens | Potency | 39810.7 | nM | PubChem BioAssay data set | |
NPT198 | Individual Protein | Vitamin D receptor | Homo sapiens | Potency | 44668.4 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 50118.7 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 44668.4 | nM | PubChem BioAssay data set | ||
NPT7 | Individual Protein | Thioredoxin reductase 1, cytoplasmic | Rattus norvegicus | Potency | 50118.7 | nM | PubChem BioAssay data set | |
NPT135 | Individual Protein | Chromobox protein homolog 1 | Homo sapiens | Potency | 70794.6 | nM | PubChem BioAssay data set | |
NPT803 | Individual Protein | Flap endonuclease 1 | Homo sapiens | Potency | 15848.9 | nM | PubChem BioAssay data set | |
NPT8 | Individual Protein | DNA polymerase iota | Homo sapiens | Potency | 50118.7 | nM | PubChem BioAssay data set | |
NPT9 | Individual Protein | DNA polymerase eta | Homo sapiens | Potency | 19952.6 | nM | PubChem BioAssay data set | |
NPT65 | Cell Line | HepG2 | Homo sapiens | Potency | 35481.3 | nM | PubChem BioAssay data set | |
NPT698 | Individual Protein | Regulator of G-protein signaling 4 | Homo sapiens | Potency | 31622.8 | nM | PubChem BioAssay data set | |
NPT199 | Individual Protein | DNA polymerase kappa | Homo sapiens | Potency | 79432.8 | nM | PubChem BioAssay data set | |
NPT918 | Individual Protein | Heat shock protein HSP 90-alpha | Homo sapiens | AC50 | = | 800 | nM | PubChem BioAssay data set |
NPT919 | Individual Protein | HSP90 | Plasmodium falciparum 3D7 | AC50 | = | 2109 | nM | PubChem BioAssay data set |
NPT534 | Individual Protein | Phosphoglycerate kinase, glycosomal | Trypanosoma brucei brucei | Potency | 22387.2 | nM | PubChem BioAssay data set | |
NPT10 | Individual Protein | Geminin | Homo sapiens | Potency | 4.6 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 10000 | nM | PubChem BioAssay data set | ||
NPT10 | Individual Protein | Geminin | Homo sapiens | Potency | 25929 | nM | PubChem BioAssay data set | |
NPT478 | Individual Protein | Ataxin-2 | Homo sapiens | Potency | 28183.8 | nM | PubChem BioAssay data set | |
NPT821 | Individual Protein | Werner syndrome ATP-dependent helicase | Homo sapiens | Potency | 50118.7 | nM | PubChem BioAssay data set | |
NPT755 | Individual Protein | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | Homo sapiens | Potency | 79432.8 | nM | PubChem BioAssay data set | |
NPT159 | Individual Protein | Aberrant vpr protein | Human immunodeficiency virus 1 | Potency | 5623.4 | nM | PubChem BioAssay data set | |
NPT66 | Individual Protein | Acetylcholinesterase | Electrophorus electricus | Inhibition | = | 3.54 | % | 23062825 |
NPT67 | Individual Protein | Cholinesterase | Equus caballus | Inhibition | = | 6.21 | % | 23062825 |
NPT2 | Others | Unspecified | Potency | 18356.4 | nM | PubChem BioAssay data set | ||
NPT2 | Others | Unspecified | Potency | 16360.1 | nM | PubChem BioAssay data set | ||
NPT920 | Individual Protein | Alpha-synuclein | Homo sapiens | Potency | 10000 | nM | PubChem BioAssay data set | |
NPT161 | Individual Protein | Rap guanine nucleotide exchange factor 4 | Homo sapiens | Potency | 8912.5 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 28183.8 | nM | PubChem BioAssay data set | ||
NPT444 | Individual Protein | Ubiquitin carboxyl-terminal hydrolase 1 | Homo sapiens | Potency | 25118.9 | nM | PubChem BioAssay data set | |
NPT535 | Individual Protein | Parathyroid hormone receptor | Homo sapiens | Potency | 28183.8 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 19952.6 | nM | PubChem BioAssay data set | ||
NPT831 | Individual Protein | Serine/threonine-protein kinase PLK1 | Homo sapiens | Potency | 1062.1 | nM | PubChem BioAssay data set | |
NPT2 | Others | Unspecified | Potency | 15848.9 | nM | PubChem BioAssay data set | ||
NPT446 | Individual Protein | Rap guanine nucleotide exchange factor 3 | Homo sapiens | Potency | 50118.7 | 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 NPC224270 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 |
---|---|---|
0.9545 | High Similarity | NPC12727 |
0.9432 | High Similarity | NPC143210 |
0.8636 | High Similarity | NPC291712 |
0.8523 | High Similarity | NPC281172 |
0.8384 | Intermediate Similarity | NPC232969 |
0.8384 | Intermediate Similarity | NPC199107 |
0.837 | Intermediate Similarity | NPC32552 |
0.837 | Intermediate Similarity | NPC193396 |
0.837 | Intermediate Similarity | NPC32944 |
0.8367 | Intermediate Similarity | NPC272528 |
0.8172 | Intermediate Similarity | NPC166110 |
0.8152 | Intermediate Similarity | NPC95364 |
0.8152 | Intermediate Similarity | NPC142159 |
0.8125 | Intermediate Similarity | NPC134083 |
0.8085 | Intermediate Similarity | NPC248193 |
0.7959 | Intermediate Similarity | NPC215253 |
0.7959 | Intermediate Similarity | NPC185253 |
0.7879 | Intermediate Similarity | NPC224172 |
0.7857 | Intermediate Similarity | NPC166770 |
0.77 | Intermediate Similarity | NPC469851 |
0.7551 | Intermediate Similarity | NPC471698 |
0.7549 | Intermediate Similarity | NPC297281 |
0.7549 | Intermediate Similarity | NPC25666 |
0.7549 | Intermediate Similarity | NPC271059 |
0.7549 | Intermediate Similarity | NPC473144 |
0.7523 | Intermediate Similarity | NPC243298 |
0.7475 | Intermediate Similarity | NPC318082 |
0.7404 | Intermediate Similarity | NPC469852 |
0.7387 | Intermediate Similarity | NPC245320 |
0.7347 | Intermediate Similarity | NPC282644 |
0.7347 | Intermediate Similarity | NPC29798 |
0.7321 | Intermediate Similarity | NPC476815 |
0.7321 | Intermediate Similarity | NPC31641 |
0.7321 | Intermediate Similarity | NPC473145 |
0.7312 | Intermediate Similarity | NPC288281 |
0.7308 | Intermediate Similarity | NPC9436 |
0.7222 | Intermediate Similarity | NPC471225 |
0.7209 | Intermediate Similarity | NPC470693 |
0.72 | Intermediate Similarity | NPC31021 |
0.717 | Intermediate Similarity | NPC469853 |
0.7128 | Intermediate Similarity | NPC16488 |
0.7103 | Intermediate Similarity | NPC327106 |
0.7091 | Intermediate Similarity | NPC321496 |
0.7033 | Intermediate Similarity | NPC180290 |
0.703 | Intermediate Similarity | NPC295347 |
0.7021 | Intermediate Similarity | NPC221231 |
0.7021 | Intermediate Similarity | NPC471326 |
0.7019 | Intermediate Similarity | NPC471699 |
0.6966 | Remote Similarity | NPC287878 |
0.6947 | Remote Similarity | NPC118423 |
0.6931 | Remote Similarity | NPC38830 |
0.6907 | Remote Similarity | NPC234038 |
0.6907 | Remote Similarity | NPC472863 |
0.6907 | Remote Similarity | NPC316426 |
0.6907 | Remote Similarity | NPC168248 |
0.6907 | Remote Similarity | NPC315395 |
0.69 | Remote Similarity | NPC45579 |
0.6893 | Remote Similarity | NPC208094 |
0.6869 | Remote Similarity | NPC280833 |
0.6869 | Remote Similarity | NPC284561 |
0.686 | Remote Similarity | NPC191233 |
0.6848 | Remote Similarity | NPC473825 |
0.6848 | Remote Similarity | NPC316324 |
0.6842 | Remote Similarity | NPC268122 |
0.6837 | Remote Similarity | NPC103743 |
0.6837 | Remote Similarity | NPC476079 |
0.6837 | Remote Similarity | NPC113370 |
0.6804 | Remote Similarity | NPC470177 |
0.6804 | Remote Similarity | NPC307112 |
0.68 | Remote Similarity | NPC469372 |
0.6796 | Remote Similarity | NPC299396 |
0.6796 | Remote Similarity | NPC301596 |
0.6796 | Remote Similarity | NPC172998 |
0.6778 | Remote Similarity | NPC276336 |
0.6774 | Remote Similarity | NPC99182 |
0.6771 | Remote Similarity | NPC475083 |
0.6768 | Remote Similarity | NPC26078 |
0.6768 | Remote Similarity | NPC473658 |
0.6744 | Remote Similarity | NPC470688 |
0.6744 | Remote Similarity | NPC220766 |
0.6739 | Remote Similarity | NPC40353 |
0.6737 | Remote Similarity | NPC475833 |
0.6737 | Remote Similarity | NPC42470 |
0.6735 | Remote Similarity | NPC203795 |
0.6705 | Remote Similarity | NPC470256 |
0.6705 | Remote Similarity | NPC134385 |
0.6703 | Remote Similarity | NPC122244 |
0.6703 | Remote Similarity | NPC476355 |
0.6703 | Remote Similarity | NPC470686 |
0.6701 | Remote Similarity | NPC196487 |
0.6701 | Remote Similarity | NPC474359 |
0.6701 | Remote Similarity | NPC14575 |
0.67 | Remote Similarity | NPC51358 |
0.67 | Remote Similarity | NPC307092 |
0.67 | Remote Similarity | NPC474844 |
0.6699 | Remote Similarity | NPC234339 |
0.6699 | Remote Similarity | NPC273197 |
0.6698 | Remote Similarity | NPC194028 |
0.6698 | Remote Similarity | NPC168319 |
0.6667 | Remote Similarity | NPC68156 |
0.6667 | Remote Similarity | NPC10080 |
0.6667 | Remote Similarity | NPC181327 |
0.6667 | Remote Similarity | NPC75315 |
0.6667 | Remote Similarity | NPC163016 |
0.6667 | Remote Similarity | NPC125925 |
0.6667 | Remote Similarity | NPC94200 |
0.6667 | Remote Similarity | NPC123908 |
0.6667 | Remote Similarity | NPC1108 |
0.6667 | Remote Similarity | NPC97173 |
0.6634 | Remote Similarity | NPC213636 |
0.6634 | Remote Similarity | NPC253177 |
0.6634 | Remote Similarity | NPC469595 |
0.6634 | Remote Similarity | NPC280592 |
0.6634 | Remote Similarity | NPC212679 |
0.6634 | Remote Similarity | NPC220454 |
0.6633 | Remote Similarity | NPC67081 |
0.6633 | Remote Similarity | NPC189311 |
0.6633 | Remote Similarity | NPC471223 |
0.6633 | Remote Similarity | NPC130030 |
0.6633 | Remote Similarity | NPC471060 |
0.6632 | Remote Similarity | NPC160582 |
0.6629 | Remote Similarity | NPC151481 |
0.6602 | Remote Similarity | NPC476596 |
0.6602 | Remote Similarity | NPC477129 |
0.6602 | Remote Similarity | NPC477130 |
0.66 | Remote Similarity | NPC475902 |
0.66 | Remote Similarity | NPC472302 |
0.66 | Remote Similarity | NPC196407 |
0.66 | Remote Similarity | NPC471057 |
0.66 | Remote Similarity | NPC471058 |
0.6598 | Remote Similarity | NPC474703 |
0.6598 | Remote Similarity | NPC222358 |
0.6591 | Remote Similarity | NPC21998 |
0.6591 | Remote Similarity | NPC194871 |
0.6591 | Remote Similarity | NPC203335 |
0.6577 | Remote Similarity | NPC228477 |
0.6577 | Remote Similarity | NPC137911 |
0.6571 | Remote Similarity | NPC202705 |
0.6571 | Remote Similarity | NPC245521 |
0.6569 | Remote Similarity | NPC471329 |
0.6569 | Remote Similarity | NPC296114 |
0.6569 | Remote Similarity | NPC469538 |
0.6566 | Remote Similarity | NPC220478 |
0.6566 | Remote Similarity | NPC279859 |
0.6566 | Remote Similarity | NPC38576 |
0.6559 | Remote Similarity | NPC27205 |
0.6559 | Remote Similarity | NPC123360 |
0.6556 | Remote Similarity | NPC59558 |
0.6556 | Remote Similarity | NPC315285 |
0.6545 | Remote Similarity | NPC266514 |
0.6535 | Remote Similarity | NPC115179 |
0.6535 | Remote Similarity | NPC106040 |
0.6535 | Remote Similarity | NPC36668 |
0.6535 | Remote Similarity | NPC471054 |
0.6535 | Remote Similarity | NPC118011 |
0.6535 | Remote Similarity | NPC212598 |
0.6531 | Remote Similarity | NPC30486 |
0.6526 | Remote Similarity | NPC473980 |
0.6526 | Remote Similarity | NPC178277 |
0.6526 | Remote Similarity | NPC471299 |
0.6526 | Remote Similarity | NPC63649 |
0.6526 | Remote Similarity | NPC270126 |
0.6526 | Remote Similarity | NPC473981 |
0.6526 | Remote Similarity | NPC264227 |
0.6526 | Remote Similarity | NPC472965 |
0.6526 | Remote Similarity | NPC271632 |
0.6522 | Remote Similarity | NPC15499 |
0.6522 | Remote Similarity | NPC474758 |
0.6522 | Remote Similarity | NPC259599 |
0.6522 | Remote Similarity | NPC117746 |
0.6522 | Remote Similarity | NPC294434 |
0.6522 | Remote Similarity | NPC140287 |
0.6518 | Remote Similarity | NPC89408 |
0.6512 | Remote Similarity | NPC155849 |
0.6512 | Remote Similarity | NPC474774 |
0.6509 | Remote Similarity | NPC264378 |
0.6505 | Remote Similarity | NPC469939 |
0.6505 | Remote Similarity | NPC476598 |
0.6505 | Remote Similarity | NPC476597 |
0.6505 | Remote Similarity | NPC242637 |
0.65 | Remote Similarity | NPC478145 |
0.6495 | Remote Similarity | NPC85772 |
0.6495 | Remote Similarity | NPC475690 |
0.6491 | Remote Similarity | NPC326264 |
0.6489 | Remote Similarity | NPC41780 |
0.6489 | Remote Similarity | NPC57744 |
0.6489 | Remote Similarity | NPC187568 |
0.6489 | Remote Similarity | NPC82666 |
0.6489 | Remote Similarity | NPC315394 |
0.6486 | Remote Similarity | NPC264819 |
0.6484 | Remote Similarity | NPC163003 |
0.6484 | Remote Similarity | NPC181587 |
0.6484 | Remote Similarity | NPC474539 |
0.6484 | Remote Similarity | NPC133098 |
0.6481 | Remote Similarity | NPC197835 |
0.6481 | Remote Similarity | NPC189609 |
0.6481 | Remote Similarity | NPC140591 |
0.6481 | Remote Similarity | NPC291500 |
0.6481 | Remote Similarity | NPC303653 |
0.6471 | Remote Similarity | NPC265856 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC224270 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 |
---|---|---|---|
0.6848 | Remote Similarity | NPD4756 | Discovery |
0.6538 | Remote Similarity | NPD5654 | Approved |
0.6495 | Remote Similarity | NPD5209 | Approved |
0.6415 | Remote Similarity | NPD5959 | Approved |
0.63 | Remote Similarity | NPD1694 | Approved |
0.6292 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.6277 | Remote Similarity | NPD8039 | Approved |
0.625 | Remote Similarity | NPD6614 | Approved |
0.625 | Remote Similarity | NPD5693 | Phase 1 |
0.625 | Remote Similarity | NPD5694 | Approved |
0.6162 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD5692 | Phase 3 |
0.6134 | Remote Similarity | NPD6314 | Approved |
0.6134 | Remote Similarity | NPD6313 | Approved |
0.6134 | Remote Similarity | NPD6335 | Approved |
0.6122 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.6117 | Remote Similarity | NPD6672 | Approved |
0.6117 | Remote Similarity | NPD5737 | Approved |
0.6095 | Remote Similarity | NPD6050 | Approved |
0.6 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5966 | Remote Similarity | NPD6868 | Approved |
0.595 | Remote Similarity | NPD7100 | Approved |
0.595 | Remote Similarity | NPD7101 | Approved |
0.593 | Remote Similarity | NPD8779 | Phase 3 |
0.5926 | Remote Similarity | NPD5695 | Phase 3 |
0.5909 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.5905 | Remote Similarity | NPD6080 | Approved |
0.5905 | Remote Similarity | NPD6904 | Approved |
0.5905 | Remote Similarity | NPD6673 | Approved |
0.5889 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.5865 | Remote Similarity | NPD3573 | Approved |
0.5826 | Remote Similarity | NPD5697 | Approved |
0.5818 | Remote Similarity | NPD6084 | Phase 2 |
0.5818 | Remote Similarity | NPD6083 | Phase 2 |
0.5812 | Remote Similarity | NPD2067 | Discontinued |
0.5785 | Remote Similarity | NPD7115 | Discovery |
0.5784 | Remote Similarity | NPD6110 | Phase 1 |
0.5784 | Remote Similarity | NPD7154 | Phase 3 |
0.5776 | Remote Similarity | NPD6881 | Approved |
0.5776 | Remote Similarity | NPD6899 | Approved |
0.5776 | Remote Similarity | NPD6011 | Approved |
0.5766 | Remote Similarity | NPD5696 | Approved |
0.5761 | Remote Similarity | NPD3704 | Approved |
0.5755 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.5741 | Remote Similarity | NPD5779 | Approved |
0.5741 | Remote Similarity | NPD5778 | Approved |
0.5728 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.5727 | Remote Similarity | NPD4792 | Clinical (unspecified phase) |
0.5726 | Remote Similarity | NPD5983 | Phase 2 |
0.5726 | Remote Similarity | NPD6014 | Approved |
0.5726 | Remote Similarity | NPD6013 | Approved |
0.5726 | Remote Similarity | NPD6012 | Approved |
0.5714 | Remote Similarity | NPD6053 | Discontinued |
0.5701 | Remote Similarity | NPD6698 | Approved |
0.5701 | Remote Similarity | NPD5785 | Approved |
0.5701 | Remote Similarity | NPD46 | Approved |
0.5701 | Remote Similarity | NPD5207 | Approved |
0.5701 | Remote Similarity | NPD7838 | Discovery |
0.5678 | Remote Similarity | NPD5169 | Approved |
0.5678 | Remote Similarity | NPD6883 | Approved |
0.5678 | Remote Similarity | NPD7102 | Approved |
0.5678 | Remote Similarity | NPD7290 | Approved |
0.5673 | Remote Similarity | NPD1696 | Phase 3 |
0.5669 | Remote Similarity | NPD6336 | Discontinued |
0.5644 | Remote Similarity | NPD4695 | Discontinued |
0.563 | Remote Similarity | NPD8130 | Phase 1 |
0.563 | Remote Similarity | NPD6650 | Approved |
0.563 | Remote Similarity | NPD6869 | Approved |
0.563 | Remote Similarity | NPD6649 | Approved |
0.563 | Remote Similarity | NPD6847 | Approved |
0.563 | Remote Similarity | NPD6617 | Approved |
0.563 | Remote Similarity | NPD5127 | Approved |
0.5619 | Remote Similarity | NPD5330 | Approved |
0.5619 | Remote Similarity | NPD6684 | Approved |
0.5619 | Remote Similarity | NPD6098 | Approved |
0.5619 | Remote Similarity | NPD7521 | Approved |
0.5619 | Remote Similarity | NPD7334 | Approved |
0.5619 | Remote Similarity | NPD7146 | Approved |
0.5619 | Remote Similarity | NPD6409 | Approved |
0.5614 | Remote Similarity | NPD5091 | Approved |
0.5607 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.5607 | Remote Similarity | NPD6101 | Approved |
0.5604 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.5603 | Remote Similarity | NPD5739 | Approved |
0.5603 | Remote Similarity | NPD6402 | Approved |
0.5603 | Remote Similarity | NPD7128 | Approved |
0.5603 | Remote Similarity | NPD6675 | Approved |
PubChem CID   | 6436015 |
ChEMBL   | CHEMBL1095515 |
ZINC   |
Molecular Weight:   | 390.12 |
ALogP:   | 1.0835 |
MLogP:   | 3.11 |
XLogP:   | 4.367 |
# Rotatable Bonds:   | 12 |
Polar Surface Area:   | 69.67 |
# H-Bond Aceptor:   | 5 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 27 |