Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO14649 | Thais orbita | Species | Muricidae | Eukaryota | UNPD* | |||
NPO1073 | Phlomis samia | Species | Lamiaceae | Eukaryota | UNPD* | |||
NPO4250 | Gloriosa superba | Species | Colchicaceae | Eukaryota | UNPD* | |||
NPO11380 | Neurolaena macrocephala | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO12144 | Fontanesia phillyreoides | Species | Oleaceae | Eukaryota | UNPD* | |||
NPO5237 | Stevia isomeca | Species | Asteraceae | Eukaryota | UNPD* | |||
NPO29691 | Fritillariae pallidiflorae bulbus | NA | NA | NA | TCMSP* | |||
NPO17922 | Fritiliariae irrhosae bulbus | NA | NA | NA | TCMSP* | |||
NPO12181 | Albizia julibrissin | Species | Fabaceae | Eukaryota | UNPD* | |||
NPO12742 | Botryotrichum peruvianum | Species | Chaetomiaceae | Eukaryota | UNPD* | |||
NPO13582 | Leucopaxillus giganteus | Species | Tricholomataceae | Eukaryota | UNPD* | |||
NPO9596 | Baeria coronaria | NA | NA | NA | UNPD* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | EC50 | > | 700 | nM | 20708941 |
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 NPC297058 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 |
---|---|---|
0.874 | High Similarity | NPC296686 |
0.8548 | High Similarity | NPC28280 |
0.8548 | High Similarity | NPC304646 |
0.8485 | Intermediate Similarity | NPC15249 |
0.8485 | Intermediate Similarity | NPC25455 |
0.8421 | Intermediate Similarity | NPC122819 |
0.8358 | Intermediate Similarity | NPC150057 |
0.8358 | Intermediate Similarity | NPC147753 |
0.8295 | Intermediate Similarity | NPC478138 |
0.8116 | Intermediate Similarity | NPC287885 |
0.8106 | Intermediate Similarity | NPC265275 |
0.8106 | Intermediate Similarity | NPC94881 |
0.8106 | Intermediate Similarity | NPC48886 |
0.791 | Intermediate Similarity | NPC317654 |
0.791 | Intermediate Similarity | NPC96010 |
0.7879 | Intermediate Similarity | NPC469943 |
0.7721 | Intermediate Similarity | NPC478136 |
0.7638 | Intermediate Similarity | NPC14630 |
0.7638 | Intermediate Similarity | NPC157530 |
0.7638 | Intermediate Similarity | NPC250089 |
0.7609 | Intermediate Similarity | NPC478139 |
0.7519 | Intermediate Similarity | NPC13190 |
0.748 | Intermediate Similarity | NPC33053 |
0.7462 | Intermediate Similarity | NPC112274 |
0.7462 | Intermediate Similarity | NPC314306 |
0.746 | Intermediate Similarity | NPC93352 |
0.7447 | Intermediate Similarity | NPC477072 |
0.7442 | Intermediate Similarity | NPC170974 |
0.7442 | Intermediate Similarity | NPC191439 |
0.7442 | Intermediate Similarity | NPC103627 |
0.7405 | Intermediate Similarity | NPC51154 |
0.7405 | Intermediate Similarity | NPC478137 |
0.7385 | Intermediate Similarity | NPC208189 |
0.7385 | Intermediate Similarity | NPC472987 |
0.7385 | Intermediate Similarity | NPC473021 |
0.7385 | Intermediate Similarity | NPC65034 |
0.7364 | Intermediate Similarity | NPC473328 |
0.7364 | Intermediate Similarity | NPC28844 |
0.7364 | Intermediate Similarity | NPC473318 |
0.7357 | Intermediate Similarity | NPC201359 |
0.7348 | Intermediate Similarity | NPC11548 |
0.7328 | Intermediate Similarity | NPC231797 |
0.7328 | Intermediate Similarity | NPC42171 |
0.7323 | Intermediate Similarity | NPC470885 |
0.7323 | Intermediate Similarity | NPC187400 |
0.7323 | Intermediate Similarity | NPC221562 |
0.731 | Intermediate Similarity | NPC180770 |
0.731 | Intermediate Similarity | NPC302276 |
0.7308 | Intermediate Similarity | NPC141433 |
0.7308 | Intermediate Similarity | NPC65155 |
0.7293 | Intermediate Similarity | NPC477029 |
0.7293 | Intermediate Similarity | NPC477030 |
0.7287 | Intermediate Similarity | NPC476540 |
0.7287 | Intermediate Similarity | NPC476541 |
0.7287 | Intermediate Similarity | NPC476539 |
0.7287 | Intermediate Similarity | NPC476538 |
0.7273 | Intermediate Similarity | NPC469348 |
0.7273 | Intermediate Similarity | NPC469347 |
0.7266 | Intermediate Similarity | NPC181845 |
0.7266 | Intermediate Similarity | NPC309448 |
0.7252 | Intermediate Similarity | NPC197231 |
0.7239 | Intermediate Similarity | NPC20979 |
0.7239 | Intermediate Similarity | NPC100048 |
0.7239 | Intermediate Similarity | NPC476690 |
0.7231 | Intermediate Similarity | NPC42482 |
0.7231 | Intermediate Similarity | NPC472901 |
0.7231 | Intermediate Similarity | NPC253645 |
0.7231 | Intermediate Similarity | NPC40440 |
0.7231 | Intermediate Similarity | NPC147835 |
0.7231 | Intermediate Similarity | NPC477027 |
0.7231 | Intermediate Similarity | NPC85001 |
0.7231 | Intermediate Similarity | NPC306131 |
0.7231 | Intermediate Similarity | NPC477026 |
0.7231 | Intermediate Similarity | NPC70204 |
0.7231 | Intermediate Similarity | NPC475670 |
0.7231 | Intermediate Similarity | NPC95920 |
0.7226 | Intermediate Similarity | NPC20035 |
0.7222 | Intermediate Similarity | NPC285231 |
0.7222 | Intermediate Similarity | NPC470434 |
0.7222 | Intermediate Similarity | NPC21568 |
0.7219 | Intermediate Similarity | NPC36463 |
0.7219 | Intermediate Similarity | NPC298005 |
0.7211 | Intermediate Similarity | NPC162910 |
0.7209 | Intermediate Similarity | NPC231340 |
0.7209 | Intermediate Similarity | NPC230507 |
0.7209 | Intermediate Similarity | NPC190395 |
0.7209 | Intermediate Similarity | NPC14704 |
0.7209 | Intermediate Similarity | NPC470432 |
0.7209 | Intermediate Similarity | NPC305423 |
0.7209 | Intermediate Similarity | NPC283829 |
0.7209 | Intermediate Similarity | NPC113044 |
0.7209 | Intermediate Similarity | NPC161676 |
0.7209 | Intermediate Similarity | NPC226642 |
0.72 | Intermediate Similarity | NPC61717 |
0.72 | Intermediate Similarity | NPC244380 |
0.7197 | Intermediate Similarity | NPC19888 |
0.7188 | Intermediate Similarity | NPC75608 |
0.7185 | Intermediate Similarity | NPC475403 |
0.7185 | Intermediate Similarity | NPC10366 |
0.7185 | Intermediate Similarity | NPC160888 |
0.7183 | Intermediate Similarity | NPC139585 |
0.7165 | Intermediate Similarity | NPC272015 |
0.7165 | Intermediate Similarity | NPC176012 |
0.7164 | Intermediate Similarity | NPC148965 |
0.7154 | Intermediate Similarity | NPC220427 |
0.7154 | Intermediate Similarity | NPC472897 |
0.7154 | Intermediate Similarity | NPC98696 |
0.7154 | Intermediate Similarity | NPC472896 |
0.7143 | Intermediate Similarity | NPC469942 |
0.7143 | Intermediate Similarity | NPC282669 |
0.7133 | Intermediate Similarity | NPC262050 |
0.7132 | Intermediate Similarity | NPC472898 |
0.7132 | Intermediate Similarity | NPC195560 |
0.7132 | Intermediate Similarity | NPC242748 |
0.7132 | Intermediate Similarity | NPC472900 |
0.7132 | Intermediate Similarity | NPC473476 |
0.7132 | Intermediate Similarity | NPC473633 |
0.7132 | Intermediate Similarity | NPC476085 |
0.7132 | Intermediate Similarity | NPC473923 |
0.7132 | Intermediate Similarity | NPC472899 |
0.7132 | Intermediate Similarity | NPC474569 |
0.7132 | Intermediate Similarity | NPC229962 |
0.7125 | Intermediate Similarity | NPC473040 |
0.7121 | Intermediate Similarity | NPC475247 |
0.7121 | Intermediate Similarity | NPC124677 |
0.7121 | Intermediate Similarity | NPC477028 |
0.7121 | Intermediate Similarity | NPC477032 |
0.7121 | Intermediate Similarity | NPC294129 |
0.712 | Intermediate Similarity | NPC473890 |
0.712 | Intermediate Similarity | NPC243728 |
0.712 | Intermediate Similarity | NPC474164 |
0.7114 | Intermediate Similarity | NPC298469 |
0.7114 | Intermediate Similarity | NPC141669 |
0.7109 | Intermediate Similarity | NPC31907 |
0.7109 | Intermediate Similarity | NPC472252 |
0.7109 | Intermediate Similarity | NPC286969 |
0.7109 | Intermediate Similarity | NPC16520 |
0.7109 | Intermediate Similarity | NPC120123 |
0.7109 | Intermediate Similarity | NPC471885 |
0.7109 | Intermediate Similarity | NPC131479 |
0.7109 | Intermediate Similarity | NPC189852 |
0.7109 | Intermediate Similarity | NPC157659 |
0.7109 | Intermediate Similarity | NPC473020 |
0.7109 | Intermediate Similarity | NPC211879 |
0.7109 | Intermediate Similarity | NPC471886 |
0.7109 | Intermediate Similarity | NPC155010 |
0.7109 | Intermediate Similarity | NPC471888 |
0.7109 | Intermediate Similarity | NPC8039 |
0.7109 | Intermediate Similarity | NPC245280 |
0.7109 | Intermediate Similarity | NPC114874 |
0.7109 | Intermediate Similarity | NPC471887 |
0.7109 | Intermediate Similarity | NPC213190 |
0.7101 | Intermediate Similarity | NPC43842 |
0.7099 | Intermediate Similarity | NPC224098 |
0.7099 | Intermediate Similarity | NPC46190 |
0.7099 | Intermediate Similarity | NPC477809 |
0.7099 | Intermediate Similarity | NPC102016 |
0.7099 | Intermediate Similarity | NPC195116 |
0.7099 | Intermediate Similarity | NPC128133 |
0.7099 | Intermediate Similarity | NPC84956 |
0.7099 | Intermediate Similarity | NPC244086 |
0.7099 | Intermediate Similarity | NPC309278 |
0.7099 | Intermediate Similarity | NPC302057 |
0.7099 | Intermediate Similarity | NPC150372 |
0.7099 | Intermediate Similarity | NPC470433 |
0.7099 | Intermediate Similarity | NPC171073 |
0.7099 | Intermediate Similarity | NPC248746 |
0.7099 | Intermediate Similarity | NPC208383 |
0.7099 | Intermediate Similarity | NPC6806 |
0.7099 | Intermediate Similarity | NPC232054 |
0.7099 | Intermediate Similarity | NPC475550 |
0.7099 | Intermediate Similarity | NPC300557 |
0.7099 | Intermediate Similarity | NPC194207 |
0.7099 | Intermediate Similarity | NPC476835 |
0.7099 | Intermediate Similarity | NPC73243 |
0.7099 | Intermediate Similarity | NPC475333 |
0.7099 | Intermediate Similarity | NPC22779 |
0.7099 | Intermediate Similarity | NPC218571 |
0.7099 | Intermediate Similarity | NPC249265 |
0.7099 | Intermediate Similarity | NPC221110 |
0.7099 | Intermediate Similarity | NPC180459 |
0.7099 | Intermediate Similarity | NPC285253 |
0.7099 | Intermediate Similarity | NPC95051 |
0.709 | Intermediate Similarity | NPC477810 |
0.708 | Intermediate Similarity | NPC198325 |
0.708 | Intermediate Similarity | NPC50689 |
0.708 | Intermediate Similarity | NPC233391 |
0.708 | Intermediate Similarity | NPC107607 |
0.708 | Intermediate Similarity | NPC207243 |
0.7077 | Intermediate Similarity | NPC317534 |
0.7075 | Intermediate Similarity | NPC265908 |
0.7068 | Intermediate Similarity | NPC254255 |
0.7068 | Intermediate Similarity | NPC473567 |
0.7068 | Intermediate Similarity | NPC216595 |
0.7067 | Intermediate Similarity | NPC214821 |
0.7067 | Intermediate Similarity | NPC298067 |
0.7063 | Intermediate Similarity | NPC5358 |
0.7063 | Intermediate Similarity | NPC216260 |
0.7063 | Intermediate Similarity | NPC158088 |
0.7059 | Intermediate Similarity | NPC218093 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC297058 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 |
---|---|---|---|
0.8421 | Intermediate Similarity | NPD8449 | Approved |
0.8358 | Intermediate Similarity | NPD8450 | Suspended |
0.7462 | Intermediate Similarity | NPD6430 | Approved |
0.7462 | Intermediate Similarity | NPD6429 | Approved |
0.7029 | Intermediate Similarity | NPD8033 | Approved |
0.6957 | Remote Similarity | NPD8377 | Approved |
0.6957 | Remote Similarity | NPD8294 | Approved |
0.6906 | Remote Similarity | NPD8296 | Approved |
0.6906 | Remote Similarity | NPD8378 | Approved |
0.6906 | Remote Similarity | NPD8335 | Approved |
0.6906 | Remote Similarity | NPD8380 | Approved |
0.6906 | Remote Similarity | NPD8379 | Approved |
0.6691 | Remote Similarity | NPD7328 | Approved |
0.6691 | Remote Similarity | NPD7327 | Approved |
0.6645 | Remote Similarity | NPD7625 | Phase 1 |
0.6643 | Remote Similarity | NPD7516 | Approved |
0.6569 | Remote Similarity | NPD7335 | Phase 2 |
0.6569 | Remote Similarity | NPD7337 | Clinical (unspecified phase) |
0.6569 | Remote Similarity | NPD7336 | Phase 2 |
0.6549 | Remote Similarity | NPD7503 | Approved |
0.6531 | Remote Similarity | NPD8392 | Approved |
0.6531 | Remote Similarity | NPD8391 | Approved |
0.6531 | Remote Similarity | NPD8390 | Approved |
0.6507 | Remote Similarity | NPD8337 | Approved |
0.6507 | Remote Similarity | NPD8336 | Approved |
0.6483 | Remote Similarity | NPD8451 | Approved |
0.6438 | Remote Similarity | NPD8448 | Approved |
0.6429 | Remote Similarity | NPD4830 | Approved |
0.6429 | Remote Similarity | NPD4832 | Approved |
0.6429 | Remote Similarity | NPD4831 | Approved |
0.6403 | Remote Similarity | NPD3731 | Phase 3 |
0.637 | Remote Similarity | NPD7507 | Approved |
0.6316 | Remote Similarity | NPD8387 | Clinical (unspecified phase) |
0.6309 | Remote Similarity | NPD6914 | Discontinued |
0.6308 | Remote Similarity | NPD7991 | Discontinued |
0.6301 | Remote Similarity | NPD8341 | Approved |
0.6301 | Remote Similarity | NPD8340 | Approved |
0.6301 | Remote Similarity | NPD8299 | Approved |
0.6301 | Remote Similarity | NPD8342 | Approved |
0.6286 | Remote Similarity | NPD8133 | Approved |
0.6268 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.625 | Remote Similarity | NPD8415 | Approved |
0.6242 | Remote Similarity | NPD7319 | Approved |
0.6233 | Remote Similarity | NPD7829 | Approved |
0.6233 | Remote Similarity | NPD7830 | Approved |
0.6225 | Remote Similarity | NPD8338 | Approved |
0.6204 | Remote Similarity | NPD6412 | Phase 2 |
0.6164 | Remote Similarity | NPD6436 | Phase 3 |
0.6159 | Remote Similarity | NPD8174 | Phase 2 |
0.6122 | Remote Similarity | NPD7122 | Discontinued |
0.6096 | Remote Similarity | NPD8517 | Approved |
0.6096 | Remote Similarity | NPD8444 | Approved |
0.6096 | Remote Similarity | NPD8515 | Approved |
0.6096 | Remote Similarity | NPD8513 | Phase 3 |
0.6096 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.6096 | Remote Similarity | NPD8516 | Approved |
0.6043 | Remote Similarity | NPD6686 | Approved |
0.6031 | Remote Similarity | NPD8171 | Discontinued |
0.6027 | Remote Similarity | NPD8346 | Approved |
0.6027 | Remote Similarity | NPD8345 | Approved |
0.6027 | Remote Similarity | NPD8347 | Approved |
0.6014 | Remote Similarity | NPD5357 | Phase 1 |
0.6013 | Remote Similarity | NPD6845 | Suspended |
0.6 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD4835 | Approved |
0.6 | Remote Similarity | NPD4837 | Approved |
0.6 | Remote Similarity | NPD4836 | Approved |
0.6 | Remote Similarity | NPD4838 | Approved |
0.5986 | Remote Similarity | NPD8269 | Approved |
0.5986 | Remote Similarity | NPD8268 | Approved |
0.5986 | Remote Similarity | NPD8267 | Approved |
0.5986 | Remote Similarity | NPD8266 | Approved |
0.596 | Remote Similarity | NPD7736 | Approved |
0.5946 | Remote Similarity | NPD8080 | Discontinued |
0.5946 | Remote Similarity | NPD6370 | Approved |
0.5906 | Remote Similarity | NPD7642 | Approved |
0.5894 | Remote Similarity | NPD8074 | Phase 3 |
0.5894 | Remote Similarity | NPD8293 | Discontinued |
0.5879 | Remote Similarity | NPD8389 | Clinical (unspecified phase) |
0.5878 | Remote Similarity | NPD6908 | Approved |
0.5878 | Remote Similarity | NPD6909 | Approved |
0.5862 | Remote Similarity | NPD7755 | Approved |
0.5862 | Remote Similarity | NPD7754 | Approved |
0.5852 | Remote Similarity | NPD4282 | Approved |
0.5845 | Remote Similarity | NPD8087 | Discontinued |
0.5844 | Remote Similarity | NPD7260 | Phase 2 |
0.5822 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.5814 | Remote Similarity | NPD8308 | Discontinued |
0.5813 | Remote Similarity | NPD8384 | Approved |
0.5811 | Remote Similarity | NPD6059 | Approved |
0.5811 | Remote Similarity | NPD6054 | Approved |
0.5804 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.5804 | Remote Similarity | NPD2204 | Approved |
0.58 | Remote Similarity | NPD8328 | Phase 3 |
0.5786 | Remote Similarity | NPD6640 | Phase 3 |
0.5782 | Remote Similarity | NPD7641 | Discontinued |
0.5769 | Remote Similarity | NPD7524 | Approved |
0.5758 | Remote Similarity | NPD3122 | Phase 3 |
0.5758 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.5753 | Remote Similarity | NPD6940 | Discontinued |
0.5725 | Remote Similarity | NPD4159 | Approved |
0.5724 | Remote Similarity | NPD8273 | Phase 1 |
0.5714 | Remote Similarity | NPD7115 | Discovery |
0.5693 | Remote Similarity | NPD7638 | Approved |
0.5674 | Remote Similarity | NPD7333 | Discontinued |
0.5667 | Remote Similarity | NPD8470 | Clinical (unspecified phase) |
0.5667 | Remote Similarity | NPD6921 | Approved |
0.5667 | Remote Similarity | NPD6016 | Approved |
0.5667 | Remote Similarity | NPD6015 | Approved |
0.5659 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.5658 | Remote Similarity | NPD7492 | Approved |
0.5658 | Remote Similarity | NPD591 | Approved |
0.5658 | Remote Similarity | NPD577 | Phase 3 |
0.5652 | Remote Similarity | NPD7639 | Approved |
0.5652 | Remote Similarity | NPD7640 | Approved |
0.5634 | Remote Similarity | NPD8140 | Approved |
0.5629 | Remote Similarity | NPD5988 | Approved |
0.5625 | Remote Similarity | NPD7237 | Clinical (unspecified phase) |
0.5621 | Remote Similarity | NPD6616 | Approved |
0.5612 | Remote Similarity | NPD7999 | Approved |
0.5603 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
PubChem CID   | 25078000 |
ChEMBL   | CHEMBL1241233 |
ZINC   |
Molecular Weight:   | 573.37 |
ALogP:   | -1.0639 |
MLogP:   | 4.21 |
XLogP:   | 2.538 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 120.64 |
# H-Bond Aceptor:   | 8 |
# H-Bond Donor:   | 5 |
# Rings:   | 7 |
# Heavy Atoms:   | 41 |