Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO17164 | Rattus norvegicus | Species | Muridae | Eukaryota |
PMID[4002232] |
|||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | urine |
PMID[27085014] |
||
NPO20338 | Mus musculus | Species | Muridae | Eukaryota |
PMID[19425150] |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT79 | Organism | Bacillus subtilis | Bacillus subtilis | IC50 | = | 717000 | nM | 6802973 |
NPT1119 | Individual Protein | Arachidonate 12-lipoxygenase | Homo sapiens | IC50 | > | 100000 | nM | 15267244 |
NPT792 | Individual Protein | Arachidonate 15-lipoxygenase | Homo sapiens | IC50 | = | 55000 | nM | 15267244 |
NPT2 | Others | Unspecified | IC50 | = | 48000 | nM | 15267244 | |
NPT137 | Cell Line | L1210 | Mus musculus | Activity | < | 15 | % | 16279782 |
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 NPC319826 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 |
---|---|---|
0.9048 | High Similarity | NPC252149 |
0.8608 | High Similarity | NPC100980 |
0.8193 | Intermediate Similarity | NPC65517 |
0.7907 | Intermediate Similarity | NPC204932 |
0.7822 | Intermediate Similarity | NPC473372 |
0.7816 | Intermediate Similarity | NPC270094 |
0.7745 | Intermediate Similarity | NPC471487 |
0.7701 | Intermediate Similarity | NPC4154 |
0.7683 | Intermediate Similarity | NPC215445 |
0.7556 | Intermediate Similarity | NPC265146 |
0.7556 | Intermediate Similarity | NPC33756 |
0.7556 | Intermediate Similarity | NPC38459 |
0.7556 | Intermediate Similarity | NPC124436 |
0.7549 | Intermediate Similarity | NPC471495 |
0.7473 | Intermediate Similarity | NPC175313 |
0.7473 | Intermediate Similarity | NPC286904 |
0.7473 | Intermediate Similarity | NPC150837 |
0.7473 | Intermediate Similarity | NPC248817 |
0.7453 | Intermediate Similarity | NPC94217 |
0.7404 | Intermediate Similarity | NPC473358 |
0.74 | Intermediate Similarity | NPC319933 |
0.7391 | Intermediate Similarity | NPC197783 |
0.7391 | Intermediate Similarity | NPC155393 |
0.7356 | Intermediate Similarity | NPC322285 |
0.7312 | Intermediate Similarity | NPC407 |
0.7312 | Intermediate Similarity | NPC307235 |
0.7312 | Intermediate Similarity | NPC184169 |
0.7312 | Intermediate Similarity | NPC280254 |
0.7312 | Intermediate Similarity | NPC23167 |
0.7234 | Intermediate Similarity | NPC113460 |
0.7234 | Intermediate Similarity | NPC157213 |
0.7234 | Intermediate Similarity | NPC27974 |
0.7234 | Intermediate Similarity | NPC25493 |
0.7234 | Intermediate Similarity | NPC104216 |
0.7196 | Intermediate Similarity | NPC59387 |
0.7196 | Intermediate Similarity | NPC471488 |
0.7196 | Intermediate Similarity | NPC33244 |
0.7182 | Intermediate Similarity | NPC191194 |
0.7158 | Intermediate Similarity | NPC258219 |
0.7158 | Intermediate Similarity | NPC280347 |
0.7158 | Intermediate Similarity | NPC98772 |
0.7158 | Intermediate Similarity | NPC177420 |
0.7158 | Intermediate Similarity | NPC318325 |
0.7158 | Intermediate Similarity | NPC242240 |
0.7158 | Intermediate Similarity | NPC123273 |
0.7143 | Intermediate Similarity | NPC54543 |
0.7117 | Intermediate Similarity | NPC44270 |
0.7117 | Intermediate Similarity | NPC86007 |
0.7083 | Intermediate Similarity | NPC312304 |
0.7083 | Intermediate Similarity | NPC55561 |
0.7083 | Intermediate Similarity | NPC300017 |
0.7083 | Intermediate Similarity | NPC192 |
0.7083 | Intermediate Similarity | NPC288923 |
0.7083 | Intermediate Similarity | NPC151764 |
0.7083 | Intermediate Similarity | NPC300478 |
0.7083 | Intermediate Similarity | NPC47950 |
0.7083 | Intermediate Similarity | NPC277758 |
0.7053 | Intermediate Similarity | NPC19680 |
0.7041 | Intermediate Similarity | NPC475466 |
0.7037 | Intermediate Similarity | NPC76400 |
0.7027 | Intermediate Similarity | NPC104124 |
0.701 | Intermediate Similarity | NPC45040 |
0.701 | Intermediate Similarity | NPC231150 |
0.701 | Intermediate Similarity | NPC322888 |
0.701 | Intermediate Similarity | NPC304541 |
0.701 | Intermediate Similarity | NPC306074 |
0.701 | Intermediate Similarity | NPC270547 |
0.701 | Intermediate Similarity | NPC155908 |
0.701 | Intermediate Similarity | NPC174048 |
0.701 | Intermediate Similarity | NPC204210 |
0.7 | Intermediate Similarity | NPC124576 |
0.6991 | Remote Similarity | NPC226737 |
0.6991 | Remote Similarity | NPC47769 |
0.6991 | Remote Similarity | NPC153580 |
0.6991 | Remote Similarity | NPC196371 |
0.6991 | Remote Similarity | NPC299939 |
0.6939 | Remote Similarity | NPC94139 |
0.6939 | Remote Similarity | NPC147284 |
0.6939 | Remote Similarity | NPC210497 |
0.6939 | Remote Similarity | NPC3358 |
0.6939 | Remote Similarity | NPC325292 |
0.6939 | Remote Similarity | NPC306884 |
0.6939 | Remote Similarity | NPC271440 |
0.6939 | Remote Similarity | NPC138117 |
0.6939 | Remote Similarity | NPC29373 |
0.6939 | Remote Similarity | NPC162314 |
0.6939 | Remote Similarity | NPC181709 |
0.6939 | Remote Similarity | NPC55903 |
0.6903 | Remote Similarity | NPC41232 |
0.6903 | Remote Similarity | NPC63317 |
0.687 | Remote Similarity | NPC175520 |
0.687 | Remote Similarity | NPC97157 |
0.687 | Remote Similarity | NPC25134 |
0.687 | Remote Similarity | NPC159866 |
0.687 | Remote Similarity | NPC64130 |
0.687 | Remote Similarity | NPC295879 |
0.6869 | Remote Similarity | NPC81010 |
0.6869 | Remote Similarity | NPC27323 |
0.6869 | Remote Similarity | NPC316301 |
0.6869 | Remote Similarity | NPC32977 |
0.6869 | Remote Similarity | NPC76938 |
0.6869 | Remote Similarity | NPC16649 |
0.6869 | Remote Similarity | NPC128062 |
0.6869 | Remote Similarity | NPC114325 |
0.6869 | Remote Similarity | NPC152415 |
0.6869 | Remote Similarity | NPC245187 |
0.6869 | Remote Similarity | NPC151715 |
0.6847 | Remote Similarity | NPC79844 |
0.6842 | Remote Similarity | NPC170824 |
0.6818 | Remote Similarity | NPC115803 |
0.6814 | Remote Similarity | NPC117759 |
0.6804 | Remote Similarity | NPC70436 |
0.68 | Remote Similarity | NPC286006 |
0.68 | Remote Similarity | NPC26244 |
0.68 | Remote Similarity | NPC313650 |
0.68 | Remote Similarity | NPC246679 |
0.68 | Remote Similarity | NPC32714 |
0.68 | Remote Similarity | NPC274678 |
0.68 | Remote Similarity | NPC107522 |
0.68 | Remote Similarity | NPC8392 |
0.68 | Remote Similarity | NPC257182 |
0.6783 | Remote Similarity | NPC137922 |
0.6783 | Remote Similarity | NPC88733 |
0.6783 | Remote Similarity | NPC173511 |
0.6783 | Remote Similarity | NPC40302 |
0.6783 | Remote Similarity | NPC474375 |
0.6768 | Remote Similarity | NPC295295 |
0.6733 | Remote Similarity | NPC202986 |
0.6733 | Remote Similarity | NPC283711 |
0.6733 | Remote Similarity | NPC216520 |
0.6733 | Remote Similarity | NPC82664 |
0.6733 | Remote Similarity | NPC292730 |
0.6733 | Remote Similarity | NPC473388 |
0.6733 | Remote Similarity | NPC259512 |
0.6733 | Remote Similarity | NPC312132 |
0.6733 | Remote Similarity | NPC132271 |
0.6724 | Remote Similarity | NPC47790 |
0.67 | Remote Similarity | NPC289769 |
0.6696 | Remote Similarity | NPC471486 |
0.6695 | Remote Similarity | NPC142776 |
0.6667 | Remote Similarity | NPC260000 |
0.6667 | Remote Similarity | NPC38483 |
0.6667 | Remote Similarity | NPC81149 |
0.6667 | Remote Similarity | NPC197576 |
0.6667 | Remote Similarity | NPC107619 |
0.6667 | Remote Similarity | NPC474073 |
0.6667 | Remote Similarity | NPC201967 |
0.6667 | Remote Similarity | NPC109955 |
0.6667 | Remote Similarity | NPC315921 |
0.6667 | Remote Similarity | NPC156313 |
0.6667 | Remote Similarity | NPC131940 |
0.6667 | Remote Similarity | NPC291789 |
0.6667 | Remote Similarity | NPC68350 |
0.6667 | Remote Similarity | NPC88420 |
0.6667 | Remote Similarity | NPC225464 |
0.6667 | Remote Similarity | NPC230013 |
0.6667 | Remote Similarity | NPC32674 |
0.6667 | Remote Similarity | NPC77492 |
0.6667 | Remote Similarity | NPC6597 |
0.6667 | Remote Similarity | NPC79241 |
0.6667 | Remote Similarity | NPC475078 |
0.6667 | Remote Similarity | NPC152097 |
0.6638 | Remote Similarity | NPC7830 |
0.6634 | Remote Similarity | NPC222146 |
0.6632 | Remote Similarity | NPC23837 |
0.6632 | Remote Similarity | NPC125306 |
0.661 | Remote Similarity | NPC137117 |
0.6607 | Remote Similarity | NPC162294 |
0.6602 | Remote Similarity | NPC130193 |
0.6602 | Remote Similarity | NPC80027 |
0.6602 | Remote Similarity | NPC131587 |
0.6602 | Remote Similarity | NPC122005 |
0.6602 | Remote Similarity | NPC299762 |
0.6602 | Remote Similarity | NPC33675 |
0.6602 | Remote Similarity | NPC275104 |
0.6602 | Remote Similarity | NPC78119 |
0.6602 | Remote Similarity | NPC125732 |
0.6602 | Remote Similarity | NPC280869 |
0.6602 | Remote Similarity | NPC171843 |
0.6602 | Remote Similarity | NPC260775 |
0.6602 | Remote Similarity | NPC132078 |
0.6602 | Remote Similarity | NPC314803 |
0.6602 | Remote Similarity | NPC128723 |
0.6602 | Remote Similarity | NPC92730 |
0.6602 | Remote Similarity | NPC216468 |
0.6602 | Remote Similarity | NPC252821 |
0.6602 | Remote Similarity | NPC245561 |
0.6602 | Remote Similarity | NPC51333 |
0.6602 | Remote Similarity | NPC307039 |
0.6582 | Remote Similarity | NPC56072 |
0.6581 | Remote Similarity | NPC296202 |
0.6566 | Remote Similarity | NPC318429 |
0.6555 | Remote Similarity | NPC220311 |
0.6538 | Remote Similarity | NPC12931 |
0.6538 | Remote Similarity | NPC10588 |
0.6538 | Remote Similarity | NPC129373 |
0.6538 | Remote Similarity | NPC225506 |
0.6538 | Remote Similarity | NPC294741 |
0.6538 | Remote Similarity | NPC248396 |
0.6538 | Remote Similarity | NPC161571 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC319826 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 |
---|---|---|---|
0.8608 | High Similarity | NPD9087 | Approved |
0.8193 | Intermediate Similarity | NPD9088 | Approved |
0.7816 | Intermediate Similarity | NPD9089 | Approved |
0.7701 | Intermediate Similarity | NPD9093 | Approved |
0.7677 | Intermediate Similarity | NPD9244 | Approved |
0.7556 | Intermediate Similarity | NPD9073 | Approved |
0.7556 | Intermediate Similarity | NPD111 | Approved |
0.7312 | Intermediate Similarity | NPD9094 | Approved |
0.7234 | Intermediate Similarity | NPD9295 | Approved |
0.6869 | Remote Similarity | NPD1432 | Clinical (unspecified phase) |
0.6869 | Remote Similarity | NPD9296 | Approved |
0.6869 | Remote Similarity | NPD2934 | Approved |
0.6869 | Remote Similarity | NPD2933 | Approved |
0.68 | Remote Similarity | NPD2860 | Approved |
0.68 | Remote Similarity | NPD844 | Approved |
0.68 | Remote Similarity | NPD2859 | Approved |
0.6768 | Remote Similarity | NPD845 | Approved |
0.6733 | Remote Similarity | NPD288 | Approved |
0.6667 | Remote Similarity | NPD68 | Approved |
0.6667 | Remote Similarity | NPD9096 | Approved |
0.6667 | Remote Similarity | NPD9273 | Approved |
0.6667 | Remote Similarity | NPD9097 | Approved |
0.6667 | Remote Similarity | NPD9095 | Approved |
0.6602 | Remote Similarity | NPD3020 | Approved |
0.6566 | Remote Similarity | NPD9365 | Approved |
0.6538 | Remote Similarity | NPD289 | Clinical (unspecified phase) |
0.6538 | Remote Similarity | NPD1242 | Phase 1 |
0.6484 | Remote Similarity | NPD9294 | Approved |
0.6476 | Remote Similarity | NPD940 | Approved |
0.6476 | Remote Similarity | NPD846 | Approved |
0.6471 | Remote Similarity | NPD1809 | Phase 2 |
0.6355 | Remote Similarity | NPD9610 | Approved |
0.6355 | Remote Similarity | NPD9608 | Approved |
0.6262 | Remote Similarity | NPD9500 | Approved |
0.6239 | Remote Similarity | NPD1445 | Approved |
0.6239 | Remote Similarity | NPD968 | Approved |
0.6239 | Remote Similarity | NPD1444 | Approved |
0.621 | Remote Similarity | NPD1223 | Clinical (unspecified phase) |
0.6182 | Remote Similarity | NPD9265 | Clinical (unspecified phase) |
0.6182 | Remote Similarity | NPD9507 | Approved |
0.6168 | Remote Similarity | NPD291 | Approved |
0.6126 | Remote Similarity | NPD74 | Approved |
0.6126 | Remote Similarity | NPD9266 | Approved |
0.6071 | Remote Similarity | NPD3021 | Approved |
0.6071 | Remote Similarity | NPD3022 | Approved |
0.6071 | Remote Similarity | NPD9380 | Clinical (unspecified phase) |
0.6071 | Remote Similarity | NPD1792 | Phase 2 |
0.6036 | Remote Similarity | NPD9267 | Approved |
0.6036 | Remote Similarity | NPD2342 | Discontinued |
0.6036 | Remote Similarity | NPD9264 | Approved |
0.6036 | Remote Similarity | NPD9263 | Approved |
0.6018 | Remote Similarity | NPD9280 | Clinical (unspecified phase) |
0.6018 | Remote Similarity | NPD9376 | Approved |
0.6016 | Remote Similarity | NPD1318 | Phase 2 |
0.6 | Remote Similarity | NPD1169 | Approved |
0.5965 | Remote Similarity | NPD228 | Approved |
0.5952 | Remote Similarity | NPD9718 | Approved |
0.5929 | Remote Similarity | NPD4750 | Phase 3 |
0.5926 | Remote Similarity | NPD3028 | Approved |
0.5913 | Remote Similarity | NPD9379 | Approved |
0.5913 | Remote Similarity | NPD9377 | Approved |
0.5913 | Remote Similarity | NPD1105 | Clinical (unspecified phase) |
0.5909 | Remote Similarity | NPD9501 | Approved |
0.5893 | Remote Similarity | NPD9552 | Approved |
0.5893 | Remote Similarity | NPD290 | Approved |
0.5862 | Remote Similarity | NPD2229 | Approved |
0.5862 | Remote Similarity | NPD2234 | Approved |
0.5862 | Remote Similarity | NPD2228 | Approved |
0.5812 | Remote Similarity | NPD9618 | Approved |
0.5812 | Remote Similarity | NPD9614 | Approved |
0.5812 | Remote Similarity | NPD1476 | Clinical (unspecified phase) |
0.5812 | Remote Similarity | NPD1791 | Approved |
0.5812 | Remote Similarity | NPD1793 | Approved |
0.5812 | Remote Similarity | NPD9299 | Approved |
0.5776 | Remote Similarity | NPD7635 | Approved |
0.5763 | Remote Similarity | NPD6671 | Approved |
0.5763 | Remote Similarity | NPD256 | Approved |
0.5763 | Remote Similarity | NPD9342 | Approved |
0.5763 | Remote Similarity | NPD255 | Approved |
0.5714 | Remote Similarity | NPD9568 | Approved |
0.5714 | Remote Similarity | NPD9493 | Approved |
0.5714 | Remote Similarity | NPD405 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD9250 | Approved |
0.5702 | Remote Similarity | NPD2684 | Approved |
0.569 | Remote Similarity | NPD6124 | Clinical (unspecified phase) |
0.5678 | Remote Similarity | NPD9281 | Approved |
0.5676 | Remote Similarity | NPD9261 | Approved |
0.5673 | Remote Similarity | NPD9256 | Approved |
0.5673 | Remote Similarity | NPD9258 | Approved |
0.5667 | Remote Similarity | NPD317 | Approved |
0.5667 | Remote Similarity | NPD9613 | Approved |
0.5667 | Remote Similarity | NPD9616 | Approved |
0.5667 | Remote Similarity | NPD856 | Approved |
0.5667 | Remote Similarity | NPD313 | Approved |
0.5667 | Remote Similarity | NPD318 | Approved |
0.5667 | Remote Similarity | NPD16 | Approved |
0.5667 | Remote Similarity | NPD9615 | Approved |
0.5652 | Remote Similarity | NPD556 | Approved |
0.5641 | Remote Similarity | NPD821 | Approved |
0.562 | Remote Similarity | NPD2226 | Clinical (unspecified phase) |
0.562 | Remote Similarity | NPD3091 | Approved |
0.562 | Remote Similarity | NPD1759 | Phase 1 |
0.562 | Remote Similarity | NPD5304 | Approved |
0.562 | Remote Similarity | NPD5303 | Approved |
0.562 | Remote Similarity | NPD316 | Approved |
0.562 | Remote Similarity | NPD1548 | Phase 1 |
0.562 | Remote Similarity | NPD9545 | Approved |
PubChem CID   | 7808 |
ChEMBL   | CHEMBL57284 |
ZINC   |
Molecular Weight:   | 171.95 |
ALogP:   | 0.4285 |
MLogP:   | 1.9 |
XLogP:   | 2.267 |
# Rotatable Bonds:   | 2 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 0 |
# H-Bond Donor:   | 1 |
# Rings:   | 1 |
# Heavy Atoms:   | 8 |