Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[24029555] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | urine |
PMID[12092571] |
||
NPO19866 | Arabidopsis thaliana | Species | Brassicaceae | Eukaryota |
PMID[25518943] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Activity | = | 68.4 | % | 22647881 | |
NPT1793 | Individual Protein | Putative cytochrome P450 125 | Mycobacterium tuberculosis | Activity | = | 50.9 | % | 22647881 |
NPT2 | Others | Unspecified | Activity | = | 43.1 | % | 22647881 |
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 NPC218585 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 | NPC148174 |
1.0 | High Similarity | NPC71460 |
0.9828 | High Similarity | NPC114891 |
0.9661 | High Similarity | NPC69149 |
0.95 | High Similarity | NPC473276 |
0.95 | High Similarity | NPC474380 |
0.95 | High Similarity | NPC41577 |
0.9344 | High Similarity | NPC142712 |
0.9333 | High Similarity | NPC167995 |
0.9333 | High Similarity | NPC159654 |
0.9333 | High Similarity | NPC118937 |
0.9333 | High Similarity | NPC281540 |
0.9194 | High Similarity | NPC475884 |
0.9194 | High Similarity | NPC473230 |
0.9194 | High Similarity | NPC48079 |
0.9138 | High Similarity | NPC476735 |
0.9048 | High Similarity | NPC472741 |
0.9032 | High Similarity | NPC44122 |
0.8906 | High Similarity | NPC129829 |
0.8906 | High Similarity | NPC241085 |
0.8906 | High Similarity | NPC470830 |
0.8906 | High Similarity | NPC66407 |
0.8906 | High Similarity | NPC107919 |
0.8906 | High Similarity | NPC477820 |
0.8906 | High Similarity | NPC299948 |
0.8906 | High Similarity | NPC254037 |
0.8769 | High Similarity | NPC192192 |
0.8769 | High Similarity | NPC251201 |
0.8769 | High Similarity | NPC232925 |
0.8769 | High Similarity | NPC282454 |
0.8769 | High Similarity | NPC63588 |
0.8769 | High Similarity | NPC231945 |
0.8636 | High Similarity | NPC157422 |
0.8636 | High Similarity | NPC109457 |
0.8636 | High Similarity | NPC127094 |
0.8636 | High Similarity | NPC58057 |
0.8636 | High Similarity | NPC478103 |
0.8636 | High Similarity | NPC320549 |
0.8636 | High Similarity | NPC100586 |
0.8636 | High Similarity | NPC111234 |
0.8636 | High Similarity | NPC156277 |
0.8636 | High Similarity | NPC1340 |
0.8636 | High Similarity | NPC187471 |
0.8636 | High Similarity | NPC470071 |
0.8636 | High Similarity | NPC473279 |
0.8636 | High Similarity | NPC195530 |
0.8636 | High Similarity | NPC151018 |
0.8636 | High Similarity | NPC252182 |
0.8594 | High Similarity | NPC63190 |
0.8571 | High Similarity | NPC243469 |
0.8571 | High Similarity | NPC190827 |
0.8571 | High Similarity | NPC475943 |
0.8548 | High Similarity | NPC292419 |
0.8548 | High Similarity | NPC290791 |
0.8507 | High Similarity | NPC153719 |
0.8507 | High Similarity | NPC195489 |
0.8507 | High Similarity | NPC472341 |
0.8507 | High Similarity | NPC470610 |
0.8507 | High Similarity | NPC232112 |
0.8507 | High Similarity | NPC473238 |
0.85 | High Similarity | NPC162685 |
0.8485 | Intermediate Similarity | NPC45296 |
0.8382 | Intermediate Similarity | NPC478130 |
0.8382 | Intermediate Similarity | NPC196358 |
0.8382 | Intermediate Similarity | NPC62657 |
0.8382 | Intermediate Similarity | NPC145552 |
0.8382 | Intermediate Similarity | NPC254509 |
0.8382 | Intermediate Similarity | NPC228994 |
0.8382 | Intermediate Similarity | NPC48795 |
0.8382 | Intermediate Similarity | NPC280026 |
0.8382 | Intermediate Similarity | NPC192638 |
0.8382 | Intermediate Similarity | NPC5046 |
0.8382 | Intermediate Similarity | NPC192501 |
0.8382 | Intermediate Similarity | NPC477508 |
0.8382 | Intermediate Similarity | NPC10476 |
0.8382 | Intermediate Similarity | NPC25511 |
0.8382 | Intermediate Similarity | NPC49168 |
0.8382 | Intermediate Similarity | NPC304499 |
0.8382 | Intermediate Similarity | NPC167702 |
0.8382 | Intermediate Similarity | NPC254340 |
0.8361 | Intermediate Similarity | NPC95958 |
0.8358 | Intermediate Similarity | NPC131506 |
0.8358 | Intermediate Similarity | NPC157777 |
0.8333 | Intermediate Similarity | NPC99264 |
0.8333 | Intermediate Similarity | NPC135438 |
0.8333 | Intermediate Similarity | NPC327728 |
0.8333 | Intermediate Similarity | NPC213178 |
0.8333 | Intermediate Similarity | NPC131892 |
0.8333 | Intermediate Similarity | NPC6120 |
0.8281 | Intermediate Similarity | NPC472946 |
0.8281 | Intermediate Similarity | NPC477603 |
0.8281 | Intermediate Similarity | NPC260116 |
0.8281 | Intermediate Similarity | NPC80463 |
0.8261 | Intermediate Similarity | NPC97534 |
0.8261 | Intermediate Similarity | NPC174964 |
0.8261 | Intermediate Similarity | NPC230704 |
0.8261 | Intermediate Similarity | NPC240235 |
0.8261 | Intermediate Similarity | NPC195155 |
0.8261 | Intermediate Similarity | NPC212879 |
0.8261 | Intermediate Similarity | NPC70982 |
0.8261 | Intermediate Similarity | NPC178383 |
0.8261 | Intermediate Similarity | NPC243027 |
0.8261 | Intermediate Similarity | NPC212733 |
0.8261 | Intermediate Similarity | NPC3403 |
0.8261 | Intermediate Similarity | NPC231680 |
0.8261 | Intermediate Similarity | NPC231256 |
0.8261 | Intermediate Similarity | NPC158208 |
0.8261 | Intermediate Similarity | NPC270306 |
0.8261 | Intermediate Similarity | NPC317242 |
0.8261 | Intermediate Similarity | NPC273366 |
0.8261 | Intermediate Similarity | NPC200243 |
0.8261 | Intermediate Similarity | NPC91387 |
0.8261 | Intermediate Similarity | NPC103822 |
0.8261 | Intermediate Similarity | NPC196136 |
0.8261 | Intermediate Similarity | NPC185536 |
0.8261 | Intermediate Similarity | NPC104387 |
0.8254 | Intermediate Similarity | NPC236099 |
0.8254 | Intermediate Similarity | NPC209686 |
0.8254 | Intermediate Similarity | NPC249078 |
0.8182 | Intermediate Similarity | NPC474756 |
0.8143 | Intermediate Similarity | NPC163597 |
0.8143 | Intermediate Similarity | NPC470145 |
0.8143 | Intermediate Similarity | NPC86305 |
0.8143 | Intermediate Similarity | NPC4209 |
0.8143 | Intermediate Similarity | NPC278091 |
0.8143 | Intermediate Similarity | NPC78067 |
0.8143 | Intermediate Similarity | NPC5767 |
0.8143 | Intermediate Similarity | NPC237460 |
0.8143 | Intermediate Similarity | NPC477602 |
0.8143 | Intermediate Similarity | NPC472486 |
0.8143 | Intermediate Similarity | NPC473916 |
0.8143 | Intermediate Similarity | NPC477601 |
0.8143 | Intermediate Similarity | NPC14112 |
0.8143 | Intermediate Similarity | NPC91573 |
0.8143 | Intermediate Similarity | NPC93662 |
0.8143 | Intermediate Similarity | NPC472487 |
0.8143 | Intermediate Similarity | NPC475742 |
0.8116 | Intermediate Similarity | NPC472503 |
0.8116 | Intermediate Similarity | NPC308440 |
0.8095 | Intermediate Similarity | NPC95804 |
0.8095 | Intermediate Similarity | NPC185547 |
0.8088 | Intermediate Similarity | NPC89310 |
0.8088 | Intermediate Similarity | NPC8004 |
0.8088 | Intermediate Similarity | NPC127283 |
0.8033 | Intermediate Similarity | NPC236588 |
0.803 | Intermediate Similarity | NPC475172 |
0.803 | Intermediate Similarity | NPC204233 |
0.8028 | Intermediate Similarity | NPC105208 |
0.8028 | Intermediate Similarity | NPC23884 |
0.8028 | Intermediate Similarity | NPC476233 |
0.8028 | Intermediate Similarity | NPC11907 |
0.8028 | Intermediate Similarity | NPC221420 |
0.8028 | Intermediate Similarity | NPC119355 |
0.8028 | Intermediate Similarity | NPC133596 |
0.8028 | Intermediate Similarity | NPC302578 |
0.8028 | Intermediate Similarity | NPC64081 |
0.8028 | Intermediate Similarity | NPC212241 |
0.8028 | Intermediate Similarity | NPC257191 |
0.8028 | Intermediate Similarity | NPC128951 |
0.8028 | Intermediate Similarity | NPC202540 |
0.8028 | Intermediate Similarity | NPC298168 |
0.8028 | Intermediate Similarity | NPC192046 |
0.8028 | Intermediate Similarity | NPC207010 |
0.8028 | Intermediate Similarity | NPC477227 |
0.8028 | Intermediate Similarity | NPC248830 |
0.8028 | Intermediate Similarity | NPC475031 |
0.8028 | Intermediate Similarity | NPC185915 |
0.8028 | Intermediate Similarity | NPC143133 |
0.8028 | Intermediate Similarity | NPC331618 |
0.8028 | Intermediate Similarity | NPC317913 |
0.8028 | Intermediate Similarity | NPC474574 |
0.8 | Intermediate Similarity | NPC257347 |
0.8 | Intermediate Similarity | NPC125767 |
0.8 | Intermediate Similarity | NPC476737 |
0.8 | Intermediate Similarity | NPC21220 |
0.8 | Intermediate Similarity | NPC141071 |
0.8 | Intermediate Similarity | NPC27243 |
0.8 | Intermediate Similarity | NPC471723 |
0.7971 | Intermediate Similarity | NPC310766 |
0.7971 | Intermediate Similarity | NPC201373 |
0.7917 | Intermediate Similarity | NPC185465 |
0.7917 | Intermediate Similarity | NPC80089 |
0.7917 | Intermediate Similarity | NPC34046 |
0.7917 | Intermediate Similarity | NPC102708 |
0.7917 | Intermediate Similarity | NPC65897 |
0.7917 | Intermediate Similarity | NPC285761 |
0.7917 | Intermediate Similarity | NPC167037 |
0.7917 | Intermediate Similarity | NPC147993 |
0.7917 | Intermediate Similarity | NPC301707 |
0.7917 | Intermediate Similarity | NPC302041 |
0.7917 | Intermediate Similarity | NPC31828 |
0.7917 | Intermediate Similarity | NPC6978 |
0.7917 | Intermediate Similarity | NPC477817 |
0.7917 | Intermediate Similarity | NPC472342 |
0.7917 | Intermediate Similarity | NPC18857 |
0.7917 | Intermediate Similarity | NPC471769 |
0.7917 | Intermediate Similarity | NPC42853 |
0.7917 | Intermediate Similarity | NPC67657 |
0.7917 | Intermediate Similarity | NPC171426 |
0.7917 | Intermediate Similarity | NPC138621 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC218585 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 |
---|---|---|---|
0.8906 | High Similarity | NPD4267 | Clinical (unspecified phase) |
0.8769 | High Similarity | NPD4787 | Phase 1 |
0.8636 | High Similarity | NPD4809 | Clinical (unspecified phase) |
0.8636 | High Similarity | NPD4808 | Clinical (unspecified phase) |
0.8382 | Intermediate Similarity | NPD6113 | Clinical (unspecified phase) |
0.8333 | Intermediate Similarity | NPD3700 | Clinical (unspecified phase) |
0.8333 | Intermediate Similarity | NPD3699 | Clinical (unspecified phase) |
0.8143 | Intermediate Similarity | NPD6117 | Approved |
0.8028 | Intermediate Similarity | NPD6116 | Phase 1 |
0.7941 | Intermediate Similarity | NPD4789 | Approved |
0.7941 | Intermediate Similarity | NPD4245 | Approved |
0.7941 | Intermediate Similarity | NPD4244 | Approved |
0.7917 | Intermediate Similarity | NPD6697 | Approved |
0.7917 | Intermediate Similarity | NPD6118 | Approved |
0.7917 | Intermediate Similarity | NPD6115 | Approved |
0.7917 | Intermediate Similarity | NPD6114 | Approved |
0.791 | Intermediate Similarity | NPD5361 | Clinical (unspecified phase) |
0.791 | Intermediate Similarity | NPD5360 | Phase 3 |
0.7794 | Intermediate Similarity | NPD3698 | Phase 2 |
0.7746 | Intermediate Similarity | NPD6942 | Approved |
0.7746 | Intermediate Similarity | NPD7339 | Approved |
0.7746 | Intermediate Similarity | NPD3703 | Phase 2 |
0.7727 | Intermediate Similarity | NPD3171 | Clinical (unspecified phase) |
0.7703 | Intermediate Similarity | NPD6928 | Phase 2 |
0.7703 | Intermediate Similarity | NPD7525 | Registered |
0.7432 | Intermediate Similarity | NPD3671 | Phase 1 |
0.7391 | Intermediate Similarity | NPD6705 | Phase 1 |
0.7324 | Intermediate Similarity | NPD4758 | Discontinued |
0.7241 | Intermediate Similarity | NPD385 | Approved |
0.7241 | Intermediate Similarity | NPD384 | Approved |
0.7215 | Intermediate Similarity | NPD7520 | Clinical (unspecified phase) |
0.7162 | Intermediate Similarity | NPD3701 | Clinical (unspecified phase) |
0.7101 | Intermediate Similarity | NPD4224 | Phase 2 |
0.7083 | Intermediate Similarity | NPD6081 | Approved |
0.7013 | Intermediate Similarity | NPD4748 | Discontinued |
0.6974 | Remote Similarity | NPD5364 | Discontinued |
0.6892 | Remote Similarity | NPD6924 | Approved |
0.6892 | Remote Similarity | NPD6926 | Approved |
0.6883 | Remote Similarity | NPD7645 | Phase 2 |
0.6875 | Remote Similarity | NPD4786 | Approved |
0.6849 | Remote Similarity | NPD7151 | Approved |
0.6849 | Remote Similarity | NPD7150 | Approved |
0.6849 | Remote Similarity | NPD7152 | Approved |
0.6849 | Remote Similarity | NPD4243 | Approved |
0.6849 | Remote Similarity | NPD5777 | Approved |
0.6806 | Remote Similarity | NPD6923 | Approved |
0.6806 | Remote Similarity | NPD6922 | Approved |
0.68 | Remote Similarity | NPD3702 | Approved |
0.6786 | Remote Similarity | NPD6701 | Clinical (unspecified phase) |
0.6786 | Remote Similarity | NPD6700 | Approved |
0.675 | Remote Similarity | NPD4788 | Approved |
0.6712 | Remote Similarity | NPD7144 | Approved |
0.6712 | Remote Similarity | NPD7143 | Approved |
0.6711 | Remote Similarity | NPD6933 | Approved |
0.6706 | Remote Similarity | NPD6702 | Approved |
0.6706 | Remote Similarity | NPD6703 | Approved |
0.6667 | Remote Similarity | NPD4785 | Approved |
0.6667 | Remote Similarity | NPD5328 | Approved |
0.6667 | Remote Similarity | NPD4784 | Approved |
0.6628 | Remote Similarity | NPD8171 | Discontinued |
0.6625 | Remote Similarity | NPD3667 | Approved |
0.6512 | Remote Similarity | NPD8035 | Phase 2 |
0.6512 | Remote Similarity | NPD6079 | Approved |
0.6512 | Remote Similarity | NPD8034 | Phase 2 |
0.6506 | Remote Similarity | NPD3618 | Phase 1 |
0.6456 | Remote Similarity | NPD6929 | Approved |
0.6429 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6375 | Remote Similarity | NPD7509 | Discontinued |
0.6375 | Remote Similarity | NPD6930 | Phase 2 |
0.6375 | Remote Similarity | NPD6931 | Approved |
0.6364 | Remote Similarity | NPD5275 | Approved |
0.6364 | Remote Similarity | NPD4190 | Phase 3 |
0.6333 | Remote Similarity | NPD7920 | Phase 3 |
0.6333 | Remote Similarity | NPD7919 | Phase 3 |
0.631 | Remote Similarity | NPD8308 | Discontinued |
0.6292 | Remote Similarity | NPD7991 | Discontinued |
0.6265 | Remote Similarity | NPD3665 | Phase 1 |
0.6265 | Remote Similarity | NPD3133 | Approved |
0.6265 | Remote Similarity | NPD3666 | Approved |
0.6264 | Remote Similarity | NPD8088 | Phase 1 |
0.625 | Remote Similarity | NPD4202 | Approved |
0.623 | Remote Similarity | NPD388 | Approved |
0.623 | Remote Similarity | NPD386 | Approved |
0.6203 | Remote Similarity | NPD5776 | Phase 2 |
0.6203 | Remote Similarity | NPD6932 | Approved |
0.6203 | Remote Similarity | NPD6925 | Approved |
0.6196 | Remote Similarity | NPD8418 | Phase 2 |
0.6145 | Remote Similarity | NPD6695 | Phase 3 |
0.6125 | Remote Similarity | NPD7145 | Approved |
0.6111 | Remote Similarity | NPD371 | Approved |
0.6087 | Remote Similarity | NPD7638 | Approved |
0.6071 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6067 | Remote Similarity | NPD6399 | Phase 3 |
0.6049 | Remote Similarity | NPD4195 | Approved |
0.6049 | Remote Similarity | NPD6683 | Phase 2 |
0.6044 | Remote Similarity | NPD5221 | Approved |
0.6044 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6044 | Remote Similarity | NPD4697 | Phase 3 |
0.6044 | Remote Similarity | NPD5222 | Approved |
0.6022 | Remote Similarity | NPD7639 | Approved |
0.6022 | Remote Similarity | NPD7640 | Approved |
0.6 | Remote Similarity | NPD6893 | Approved |
0.6 | Remote Similarity | NPD3198 | Approved |
0.5978 | Remote Similarity | NPD4755 | Approved |
0.5978 | Remote Similarity | NPD5173 | Approved |
0.5976 | Remote Similarity | NPD7514 | Phase 3 |
0.5955 | Remote Similarity | NPD7515 | Phase 2 |
0.5938 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD5279 | Phase 3 |
0.5926 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD3617 | Approved |
0.5909 | Remote Similarity | NPD4753 | Phase 2 |
0.5904 | Remote Similarity | NPD6902 | Approved |
0.5895 | Remote Similarity | NPD7632 | Discontinued |
0.5882 | Remote Similarity | NPD3668 | Phase 3 |
0.5876 | Remote Similarity | NPD6920 | Discontinued |
0.5862 | Remote Similarity | NPD7524 | Approved |
0.5862 | Remote Similarity | NPD7750 | Discontinued |
0.5851 | Remote Similarity | NPD5285 | Approved |
0.5851 | Remote Similarity | NPD5286 | Approved |
0.5851 | Remote Similarity | NPD4696 | Approved |
0.5851 | Remote Similarity | NPD4700 | Approved |
0.5833 | Remote Similarity | NPD4221 | Approved |
0.5833 | Remote Similarity | NPD4223 | Phase 3 |
0.5814 | Remote Similarity | NPD5329 | Approved |
0.5797 | Remote Similarity | NPD586 | Phase 1 |
0.5789 | Remote Similarity | NPD5223 | Approved |
0.5783 | Remote Similarity | NPD7332 | Phase 2 |
0.5758 | Remote Similarity | NPD6415 | Discontinued |
0.575 | Remote Similarity | NPD8264 | Approved |
0.5745 | Remote Similarity | NPD5290 | Discontinued |
0.5729 | Remote Similarity | NPD5226 | Approved |
0.5729 | Remote Similarity | NPD5225 | Approved |
0.5729 | Remote Similarity | NPD5211 | Phase 2 |
0.5729 | Remote Similarity | NPD5224 | Approved |
0.5729 | Remote Similarity | NPD4633 | Approved |
0.5714 | Remote Similarity | NPD4139 | Approved |
0.5714 | Remote Similarity | NPD7128 | Approved |
0.5714 | Remote Similarity | NPD5739 | Approved |
0.5714 | Remote Similarity | NPD6898 | Phase 1 |
0.5714 | Remote Similarity | NPD4692 | Approved |
0.5714 | Remote Similarity | NPD6675 | Approved |
0.5714 | Remote Similarity | NPD6402 | Approved |
0.5698 | Remote Similarity | NPD4197 | Approved |
0.567 | Remote Similarity | NPD5175 | Approved |
0.567 | Remote Similarity | NPD4754 | Approved |
0.567 | Remote Similarity | NPD5174 | Approved |
0.5657 | Remote Similarity | NPD7646 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD7748 | Approved |
0.5645 | Remote Similarity | NPD367 | Approved |
0.5638 | Remote Similarity | NPD6083 | Phase 2 |
0.5638 | Remote Similarity | NPD6084 | Phase 2 |
0.5625 | Remote Similarity | NPD4159 | Approved |
0.5625 | Remote Similarity | NPD1811 | Approved |
0.5625 | Remote Similarity | NPD1810 | Approved |
0.5618 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5612 | Remote Similarity | NPD5141 | Approved |
0.5604 | Remote Similarity | NPD7087 | Discontinued |
0.56 | Remote Similarity | NPD6899 | Approved |
0.56 | Remote Similarity | NPD7320 | Approved |
0.56 | Remote Similarity | NPD6881 | Approved |
PubChem CID   | 221122 |
ChEMBL   | CHEMBL2048325 |
ZINC   |
Molecular Weight:   | 388.37 |
ALogP:   | 1.6185 |
MLogP:   | 4.32 |
XLogP:   | 11.783 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 4 |
# Heavy Atoms:   | 28 |