Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO26994 | Lobophytum pauciflorum | Species | Alcyoniidae | Eukaryota | Mindoro, Philippines |
PMID[9548875] |
||
NPO27691 | Eunicea fusca | Species | Plexauridae | Eukaryota | Caribbean |
PMID[21865038] |
||
NPO26994 | Lobophytum pauciflorum | Species | Alcyoniidae | Eukaryota |
PMID[22209732] |
|||
NPO27691 | Eunicea fusca | Species | Plexauridae | Eukaryota |
PMID[22734800] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT985 | Organism | Cladosporium cucumerinum | Cladosporium cucumerinum | IZ | = | 0 | mm | 19226154 |
NPT32 | Organism | Mus musculus | Mus musculus | Activity | = | 46 | % | 22292922 |
NPT176 | Organism | Artemia salina | Artemia salina | LC50 | = | 4.18 | ug/ml | 25467159 |
NPT762 | Cell Line | A-431 | Homo sapiens | IC50 | = | 520 | nM | 21421320 |
NPT32 | Organism | Mus musculus | Mus musculus | Inhibition | = | 0.1 | % | 2128517 |
NPT985 | Organism | Cladosporium cucumerinum | Cladosporium cucumerinum | IZ | = | 0 | mm | 19689125 |
NPT985 | Organism | Cladosporium cucumerinum | Cladosporium cucumerinum | IZ | = | 2 | mm | 23199475 |
NPT32 | Organism | Mus musculus | Mus musculus | Inhibition | = | 27.3 | % | 21982796 |
NPT985 | Organism | Cladosporium cucumerinum | Cladosporium cucumerinum | IZ | = | 0 | mm | 18198839 |
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 NPC176621 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 |
---|---|---|
0.9483 | High Similarity | NPC469728 |
0.8475 | Intermediate Similarity | NPC11130 |
0.8281 | Intermediate Similarity | NPC279434 |
0.8 | Intermediate Similarity | NPC55412 |
0.8 | Intermediate Similarity | NPC249645 |
0.7931 | Intermediate Similarity | NPC208638 |
0.791 | Intermediate Similarity | NPC476431 |
0.7857 | Intermediate Similarity | NPC124851 |
0.7812 | Intermediate Similarity | NPC174956 |
0.7727 | Intermediate Similarity | NPC259156 |
0.7727 | Intermediate Similarity | NPC242945 |
0.7727 | Intermediate Similarity | NPC250977 |
0.7656 | Intermediate Similarity | NPC41160 |
0.7619 | Intermediate Similarity | NPC309825 |
0.7612 | Intermediate Similarity | NPC114651 |
0.7576 | Intermediate Similarity | NPC107258 |
0.7571 | Intermediate Similarity | NPC130665 |
0.7538 | Intermediate Similarity | NPC283247 |
0.7538 | Intermediate Similarity | NPC81615 |
0.7536 | Intermediate Similarity | NPC34834 |
0.7465 | Intermediate Similarity | NPC201048 |
0.7465 | Intermediate Similarity | NPC476366 |
0.7463 | Intermediate Similarity | NPC149680 |
0.7463 | Intermediate Similarity | NPC255781 |
0.7419 | Intermediate Similarity | NPC39068 |
0.7414 | Intermediate Similarity | NPC22765 |
0.7414 | Intermediate Similarity | NPC17518 |
0.7397 | Intermediate Similarity | NPC91665 |
0.7385 | Intermediate Similarity | NPC326645 |
0.7385 | Intermediate Similarity | NPC317025 |
0.7385 | Intermediate Similarity | NPC210346 |
0.7385 | Intermediate Similarity | NPC317177 |
0.7385 | Intermediate Similarity | NPC329416 |
0.7361 | Intermediate Similarity | NPC69383 |
0.7361 | Intermediate Similarity | NPC32832 |
0.7361 | Intermediate Similarity | NPC313179 |
0.7361 | Intermediate Similarity | NPC171148 |
0.7353 | Intermediate Similarity | NPC69649 |
0.7353 | Intermediate Similarity | NPC68703 |
0.7333 | Intermediate Similarity | NPC68014 |
0.7313 | Intermediate Similarity | NPC64123 |
0.7288 | Intermediate Similarity | NPC26960 |
0.7288 | Intermediate Similarity | NPC182102 |
0.7286 | Intermediate Similarity | NPC189745 |
0.7286 | Intermediate Similarity | NPC475728 |
0.726 | Intermediate Similarity | NPC470749 |
0.726 | Intermediate Similarity | NPC265588 |
0.7246 | Intermediate Similarity | NPC32055 |
0.7246 | Intermediate Similarity | NPC216460 |
0.7246 | Intermediate Similarity | NPC94192 |
0.7206 | Intermediate Similarity | NPC222366 |
0.7206 | Intermediate Similarity | NPC286669 |
0.7206 | Intermediate Similarity | NPC476039 |
0.7206 | Intermediate Similarity | NPC476406 |
0.7188 | Intermediate Similarity | NPC60772 |
0.7188 | Intermediate Similarity | NPC181872 |
0.7188 | Intermediate Similarity | NPC469769 |
0.7179 | Intermediate Similarity | NPC238485 |
0.7179 | Intermediate Similarity | NPC231310 |
0.7162 | Intermediate Similarity | NPC91594 |
0.7162 | Intermediate Similarity | NPC132542 |
0.7162 | Intermediate Similarity | NPC470758 |
0.7162 | Intermediate Similarity | NPC470711 |
0.7143 | Intermediate Similarity | NPC469805 |
0.7143 | Intermediate Similarity | NPC471560 |
0.7143 | Intermediate Similarity | NPC474248 |
0.7143 | Intermediate Similarity | NPC469804 |
0.7123 | Intermediate Similarity | NPC476346 |
0.7121 | Intermediate Similarity | NPC60565 |
0.7101 | Intermediate Similarity | NPC171225 |
0.7101 | Intermediate Similarity | NPC197805 |
0.7101 | Intermediate Similarity | NPC254886 |
0.7083 | Intermediate Similarity | NPC180015 |
0.7083 | Intermediate Similarity | NPC109576 |
0.7083 | Intermediate Similarity | NPC56747 |
0.7083 | Intermediate Similarity | NPC474743 |
0.7083 | Intermediate Similarity | NPC130016 |
0.7083 | Intermediate Similarity | NPC68443 |
0.7067 | Intermediate Similarity | NPC471409 |
0.7067 | Intermediate Similarity | NPC83351 |
0.7067 | Intermediate Similarity | NPC179028 |
0.7067 | Intermediate Similarity | NPC275494 |
0.7067 | Intermediate Similarity | NPC167891 |
0.7059 | Intermediate Similarity | NPC308844 |
0.7059 | Intermediate Similarity | NPC163678 |
0.7051 | Intermediate Similarity | NPC3856 |
0.7051 | Intermediate Similarity | NPC470384 |
0.7051 | Intermediate Similarity | NPC279639 |
0.7049 | Intermediate Similarity | NPC35519 |
0.7049 | Intermediate Similarity | NPC179169 |
0.7049 | Intermediate Similarity | NPC306195 |
0.7049 | Intermediate Similarity | NPC157781 |
0.7049 | Intermediate Similarity | NPC181255 |
0.7042 | Intermediate Similarity | NPC9161 |
0.7042 | Intermediate Similarity | NPC49422 |
0.7027 | Intermediate Similarity | NPC244488 |
0.7027 | Intermediate Similarity | NPC247325 |
0.7015 | Intermediate Similarity | NPC474480 |
0.7013 | Intermediate Similarity | NPC4166 |
0.7013 | Intermediate Similarity | NPC264245 |
0.7 | Intermediate Similarity | NPC471238 |
0.7 | Intermediate Similarity | NPC329773 |
0.7 | Intermediate Similarity | NPC96484 |
0.7 | Intermediate Similarity | NPC208999 |
0.6986 | Remote Similarity | NPC104644 |
0.6986 | Remote Similarity | NPC306727 |
0.6984 | Remote Similarity | NPC329686 |
0.6974 | Remote Similarity | NPC233295 |
0.697 | Remote Similarity | NPC240506 |
0.697 | Remote Similarity | NPC234264 |
0.697 | Remote Similarity | NPC47840 |
0.697 | Remote Similarity | NPC323153 |
0.697 | Remote Similarity | NPC471081 |
0.697 | Remote Similarity | NPC135648 |
0.6964 | Remote Similarity | NPC105246 |
0.6964 | Remote Similarity | NPC190232 |
0.6957 | Remote Similarity | NPC202017 |
0.6944 | Remote Similarity | NPC470078 |
0.6944 | Remote Similarity | NPC133253 |
0.6944 | Remote Similarity | NPC167706 |
0.6944 | Remote Similarity | NPC95863 |
0.6944 | Remote Similarity | NPC471272 |
0.6923 | Remote Similarity | NPC218616 |
0.6923 | Remote Similarity | NPC49964 |
0.6923 | Remote Similarity | NPC469799 |
0.6923 | Remote Similarity | NPC87489 |
0.6923 | Remote Similarity | NPC296701 |
0.6923 | Remote Similarity | NPC469806 |
0.6923 | Remote Similarity | NPC311092 |
0.6923 | Remote Similarity | NPC202389 |
0.6912 | Remote Similarity | NPC96793 |
0.6912 | Remote Similarity | NPC469662 |
0.6912 | Remote Similarity | NPC323424 |
0.6912 | Remote Similarity | NPC107540 |
0.6912 | Remote Similarity | NPC329698 |
0.6912 | Remote Similarity | NPC225415 |
0.6912 | Remote Similarity | NPC290367 |
0.6912 | Remote Similarity | NPC475704 |
0.6901 | Remote Similarity | NPC473893 |
0.6901 | Remote Similarity | NPC269877 |
0.6901 | Remote Similarity | NPC9942 |
0.6901 | Remote Similarity | NPC167272 |
0.6897 | Remote Similarity | NPC86683 |
0.6892 | Remote Similarity | NPC471468 |
0.6892 | Remote Similarity | NPC133580 |
0.6885 | Remote Similarity | NPC214584 |
0.6885 | Remote Similarity | NPC244038 |
0.6885 | Remote Similarity | NPC26906 |
0.6883 | Remote Similarity | NPC474592 |
0.6883 | Remote Similarity | NPC469798 |
0.6883 | Remote Similarity | NPC209944 |
0.6883 | Remote Similarity | NPC234193 |
0.6883 | Remote Similarity | NPC164840 |
0.6883 | Remote Similarity | NPC469797 |
0.6883 | Remote Similarity | NPC241290 |
0.6875 | Remote Similarity | NPC264779 |
0.6875 | Remote Similarity | NPC179024 |
0.6875 | Remote Similarity | NPC473865 |
0.6875 | Remote Similarity | NPC109528 |
0.6875 | Remote Similarity | NPC474643 |
0.6866 | Remote Similarity | NPC79576 |
0.6866 | Remote Similarity | NPC194208 |
0.6866 | Remote Similarity | NPC282694 |
0.6857 | Remote Similarity | NPC176107 |
0.6857 | Remote Similarity | NPC101307 |
0.6857 | Remote Similarity | NPC88454 |
0.6857 | Remote Similarity | NPC117607 |
0.6849 | Remote Similarity | NPC153660 |
0.6849 | Remote Similarity | NPC471799 |
0.6849 | Remote Similarity | NPC182717 |
0.6842 | Remote Similarity | NPC76931 |
0.6842 | Remote Similarity | NPC297996 |
0.6842 | Remote Similarity | NPC18603 |
0.6842 | Remote Similarity | NPC11908 |
0.6842 | Remote Similarity | NPC307965 |
0.6833 | Remote Similarity | NPC17810 |
0.6825 | Remote Similarity | NPC5626 |
0.6818 | Remote Similarity | NPC5698 |
0.6818 | Remote Similarity | NPC475931 |
0.6812 | Remote Similarity | NPC268039 |
0.6812 | Remote Similarity | NPC19569 |
0.6806 | Remote Similarity | NPC145498 |
0.68 | Remote Similarity | NPC106432 |
0.68 | Remote Similarity | NPC253190 |
0.68 | Remote Similarity | NPC112680 |
0.68 | Remote Similarity | NPC292589 |
0.6795 | Remote Similarity | NPC6663 |
0.6795 | Remote Similarity | NPC249423 |
0.6795 | Remote Similarity | NPC476646 |
0.6795 | Remote Similarity | NPC47761 |
0.6774 | Remote Similarity | NPC294358 |
0.6774 | Remote Similarity | NPC71506 |
0.6774 | Remote Similarity | NPC177112 |
0.6774 | Remote Similarity | NPC40417 |
0.6765 | Remote Similarity | NPC124112 |
0.6765 | Remote Similarity | NPC202118 |
0.6765 | Remote Similarity | NPC197238 |
0.6761 | Remote Similarity | NPC310992 |
0.6761 | Remote Similarity | NPC476945 |
0.6761 | Remote Similarity | NPC160209 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC176621 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 |
---|---|---|---|
0.8 | Intermediate Similarity | NPD4219 | Approved |
0.7385 | Intermediate Similarity | NPD4194 | Approved |
0.7385 | Intermediate Similarity | NPD4191 | Approved |
0.7385 | Intermediate Similarity | NPD4193 | Approved |
0.7385 | Intermediate Similarity | NPD4192 | Approved |
0.7361 | Intermediate Similarity | NPD8264 | Approved |
0.7297 | Intermediate Similarity | NPD7322 | Clinical (unspecified phase) |
0.7105 | Intermediate Similarity | NPD7514 | Phase 3 |
0.7105 | Intermediate Similarity | NPD7332 | Phase 2 |
0.7042 | Intermediate Similarity | NPD7144 | Approved |
0.7042 | Intermediate Similarity | NPD7143 | Approved |
0.6986 | Remote Similarity | NPD4785 | Approved |
0.6986 | Remote Similarity | NPD4784 | Approved |
0.6964 | Remote Similarity | NPD1799 | Clinical (unspecified phase) |
0.6944 | Remote Similarity | NPD4243 | Approved |
0.6944 | Remote Similarity | NPD7150 | Approved |
0.6944 | Remote Similarity | NPD7151 | Approved |
0.6944 | Remote Similarity | NPD7152 | Approved |
0.6901 | Remote Similarity | NPD6922 | Approved |
0.6901 | Remote Similarity | NPD6923 | Approved |
0.6842 | Remote Similarity | NPD7145 | Approved |
0.6833 | Remote Similarity | NPD8262 | Approved |
0.6795 | Remote Similarity | NPD6902 | Approved |
0.6757 | Remote Similarity | NPD6926 | Approved |
0.6757 | Remote Similarity | NPD6924 | Approved |
0.6711 | Remote Similarity | NPD5776 | Phase 2 |
0.6711 | Remote Similarity | NPD6932 | Approved |
0.6711 | Remote Similarity | NPD6925 | Approved |
0.6667 | Remote Similarity | NPD6931 | Approved |
0.6667 | Remote Similarity | NPD6930 | Phase 2 |
0.6667 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.6618 | Remote Similarity | NPD368 | Approved |
0.6582 | Remote Similarity | NPD6898 | Phase 1 |
0.6579 | Remote Similarity | NPD6933 | Approved |
0.6538 | Remote Similarity | NPD6929 | Approved |
0.6533 | Remote Similarity | NPD4687 | Approved |
0.6533 | Remote Similarity | NPD4058 | Approved |
0.6533 | Remote Similarity | NPD5733 | Approved |
0.6447 | Remote Similarity | NPD4190 | Phase 3 |
0.6447 | Remote Similarity | NPD6942 | Approved |
0.6447 | Remote Similarity | NPD5275 | Approved |
0.6447 | Remote Similarity | NPD7339 | Approved |
0.642 | Remote Similarity | NPD6695 | Phase 3 |
0.64 | Remote Similarity | NPD4732 | Discontinued |
0.6386 | Remote Similarity | NPD4623 | Approved |
0.6386 | Remote Similarity | NPD4519 | Discontinued |
0.6341 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6329 | Remote Similarity | NPD4195 | Approved |
0.6329 | Remote Similarity | NPD6683 | Phase 2 |
0.6301 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6267 | Remote Similarity | NPD5276 | Approved |
0.6265 | Remote Similarity | NPD6893 | Approved |
0.625 | Remote Similarity | NPD7525 | Registered |
0.625 | Remote Similarity | NPD7509 | Discontinued |
0.6216 | Remote Similarity | NPD4137 | Phase 3 |
0.6212 | Remote Similarity | NPD342 | Phase 1 |
0.6176 | Remote Similarity | NPD287 | Approved |
0.6154 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6133 | Remote Similarity | NPD4747 | Approved |
0.6133 | Remote Similarity | NPD4691 | Approved |
0.6125 | Remote Similarity | NPD7645 | Phase 2 |
0.6118 | Remote Similarity | NPD7524 | Approved |
0.6118 | Remote Similarity | NPD7750 | Discontinued |
0.6118 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6071 | Remote Similarity | NPD5734 | Clinical (unspecified phase) |
0.6023 | Remote Similarity | NPD7637 | Suspended |
0.6 | Remote Similarity | NPD6048 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6049 | Phase 2 |
0.6 | Remote Similarity | NPD4694 | Approved |
0.6 | Remote Similarity | NPD5280 | Approved |
0.5921 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD6939 | Phase 2 |
0.5909 | Remote Similarity | NPD7136 | Phase 2 |
0.5904 | Remote Similarity | NPD4221 | Approved |
0.5904 | Remote Similarity | NPD4223 | Phase 3 |
0.5882 | Remote Similarity | NPD1696 | Phase 3 |
0.5882 | Remote Similarity | NPD5329 | Approved |
0.5843 | Remote Similarity | NPD5281 | Approved |
0.5843 | Remote Similarity | NPD7087 | Discontinued |
0.5843 | Remote Similarity | NPD5284 | Approved |
0.5833 | Remote Similarity | NPD3527 | Clinical (unspecified phase) |
0.5823 | Remote Similarity | NPD8039 | Approved |
0.5814 | Remote Similarity | NPD5690 | Phase 2 |
0.5802 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD319 | Phase 1 |
0.5781 | Remote Similarity | NPD4220 | Pre-registration |
0.5765 | Remote Similarity | NPD4197 | Approved |
0.5765 | Remote Similarity | NPD4786 | Approved |
0.5714 | Remote Similarity | NPD3667 | Approved |
0.5663 | Remote Similarity | NPD4695 | Discontinued |
0.5663 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5632 | Remote Similarity | NPD5205 | Approved |
0.5632 | Remote Similarity | NPD4693 | Phase 3 |
0.5632 | Remote Similarity | NPD4138 | Approved |
0.5632 | Remote Similarity | NPD4689 | Approved |
0.5632 | Remote Similarity | NPD4688 | Approved |
0.5632 | Remote Similarity | NPD5279 | Phase 3 |
0.5632 | Remote Similarity | NPD4690 | Approved |
0.5618 | Remote Similarity | NPD6051 | Approved |
0.5618 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.56 | Remote Similarity | NPD7331 | Phase 2 |
PubChem CID   | 10891538 |
ChEMBL   | CHEMBL476288 |
ZINC   |
Molecular Weight:   | 288.25 |
ALogP:   | 3.5928 |
MLogP:   | 3.55 |
XLogP:   | 6.255 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 1 |
# Heavy Atoms:   | 21 |