Organism ID | Organism Name | Taxonomy Level | Family | SuperKingdom | Isolation Part | Collection Location | Collection Time | Reference |
---|---|---|---|---|---|---|---|---|
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | blood | Geigy Scientific Tables, 8th Rev edition. Edited by C. Lentner, West Cadwell, N.J.: Medical education Div., Ciba-Geigy Corp., Basel, Switzerland c1981-1992. | ||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | urine |
PMID[21543078] |
||
NPO1797 | Homo sapiens | Species | Hominidae | Eukaryota | Faeces |
PMID[19573517] |
||
NPO29132 | Agaricus campestris | Species | Agaricaceae | Eukaryota | TCM_Taiwan* |
Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT1006 | Individual Protein | Proton-coupled amino acid transporter 1 | Homo sapiens | Ki | = | 23000000 | nM | 21955456 |
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 NPC9294 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 |
---|---|---|
0.8 | Intermediate Similarity | NPC107645 |
0.7949 | Intermediate Similarity | NPC121517 |
0.7949 | Intermediate Similarity | NPC168375 |
0.7949 | Intermediate Similarity | NPC53449 |
0.7949 | Intermediate Similarity | NPC326992 |
0.7838 | Intermediate Similarity | NPC272614 |
0.7838 | Intermediate Similarity | NPC116709 |
0.7838 | Intermediate Similarity | NPC21290 |
0.7805 | Intermediate Similarity | NPC132307 |
0.7805 | Intermediate Similarity | NPC126925 |
0.7805 | Intermediate Similarity | NPC325097 |
0.7561 | Intermediate Similarity | NPC167986 |
0.7561 | Intermediate Similarity | NPC291186 |
0.7381 | Intermediate Similarity | NPC198301 |
0.7209 | Intermediate Similarity | NPC118459 |
0.7209 | Intermediate Similarity | NPC327698 |
0.7179 | Intermediate Similarity | NPC63621 |
0.7073 | Intermediate Similarity | NPC326212 |
0.7073 | Intermediate Similarity | NPC237525 |
0.7073 | Intermediate Similarity | NPC66043 |
0.7045 | Intermediate Similarity | NPC297220 |
0.6957 | Remote Similarity | NPC226027 |
0.6957 | Remote Similarity | NPC62045 |
0.6957 | Remote Similarity | NPC84636 |
0.6957 | Remote Similarity | NPC162620 |
0.6957 | Remote Similarity | NPC245027 |
0.6957 | Remote Similarity | NPC43204 |
0.6957 | Remote Similarity | NPC174246 |
0.6889 | Remote Similarity | NPC204364 |
0.6818 | Remote Similarity | NPC329263 |
0.6765 | Remote Similarity | NPC314668 |
0.6765 | Remote Similarity | NPC230726 |
0.6757 | Remote Similarity | NPC313303 |
0.6667 | Remote Similarity | NPC49952 |
0.6667 | Remote Similarity | NPC185755 |
0.6667 | Remote Similarity | NPC136476 |
0.6667 | Remote Similarity | NPC213876 |
0.6667 | Remote Similarity | NPC155512 |
0.6596 | Remote Similarity | NPC170739 |
0.6596 | Remote Similarity | NPC93888 |
0.6596 | Remote Similarity | NPC152451 |
0.6596 | Remote Similarity | NPC270805 |
0.6596 | Remote Similarity | NPC328378 |
0.6596 | Remote Similarity | NPC193989 |
0.6585 | Remote Similarity | NPC18188 |
0.6579 | Remote Similarity | NPC114517 |
0.6522 | Remote Similarity | NPC181588 |
0.6522 | Remote Similarity | NPC136159 |
0.6512 | Remote Similarity | NPC326808 |
0.6512 | Remote Similarity | NPC226265 |
0.6512 | Remote Similarity | NPC317691 |
0.6512 | Remote Similarity | NPC254482 |
0.6512 | Remote Similarity | NPC219143 |
0.6512 | Remote Similarity | NPC110533 |
0.6458 | Remote Similarity | NPC315977 |
0.6444 | Remote Similarity | NPC285322 |
0.6444 | Remote Similarity | NPC208793 |
0.6429 | Remote Similarity | NPC327250 |
0.64 | Remote Similarity | NPC316889 |
0.64 | Remote Similarity | NPC321118 |
0.6389 | Remote Similarity | NPC126681 |
0.6383 | Remote Similarity | NPC140872 |
0.6383 | Remote Similarity | NPC93081 |
0.6383 | Remote Similarity | NPC153370 |
0.6304 | Remote Similarity | NPC309658 |
0.6286 | Remote Similarity | NPC149209 |
0.625 | Remote Similarity | NPC112890 |
0.625 | Remote Similarity | NPC316231 |
0.625 | Remote Similarity | NPC324825 |
0.6216 | Remote Similarity | NPC61066 |
0.6216 | Remote Similarity | NPC122768 |
0.6216 | Remote Similarity | NPC151140 |
0.6216 | Remote Similarity | NPC104195 |
0.62 | Remote Similarity | NPC317815 |
0.6122 | Remote Similarity | NPC114990 |
0.6122 | Remote Similarity | NPC125736 |
0.6122 | Remote Similarity | NPC273330 |
0.6122 | Remote Similarity | NPC137958 |
0.6087 | Remote Similarity | NPC191136 |
0.6061 | Remote Similarity | NPC181153 |
0.6 | Remote Similarity | NPC276294 |
0.5962 | Remote Similarity | NPC102815 |
0.5962 | Remote Similarity | NPC2801 |
0.5957 | Remote Similarity | NPC228932 |
0.5957 | Remote Similarity | NPC248970 |
0.5957 | Remote Similarity | NPC198196 |
0.5957 | Remote Similarity | NPC306238 |
0.5952 | Remote Similarity | NPC69179 |
0.5926 | Remote Similarity | NPC190385 |
0.5918 | Remote Similarity | NPC286989 |
0.5897 | Remote Similarity | NPC280532 |
0.5897 | Remote Similarity | NPC328569 |
0.5897 | Remote Similarity | NPC212144 |
0.5882 | Remote Similarity | NPC197087 |
0.5882 | Remote Similarity | NPC329495 |
0.5882 | Remote Similarity | NPC190184 |
0.587 | Remote Similarity | NPC323974 |
0.5854 | Remote Similarity | NPC134570 |
0.5849 | Remote Similarity | NPC38463 |
0.5833 | Remote Similarity | NPC316168 |
0.5833 | Remote Similarity | NPC118187 |
0.5818 | Remote Similarity | NPC316826 |
0.5818 | Remote Similarity | NPC317143 |
0.5818 | Remote Similarity | NPC321468 |
0.5818 | Remote Similarity | NPC327748 |
0.58 | Remote Similarity | NPC319175 |
0.5789 | Remote Similarity | NPC174368 |
0.5769 | Remote Similarity | NPC60672 |
0.5769 | Remote Similarity | NPC183845 |
0.5769 | Remote Similarity | NPC279661 |
0.5769 | Remote Similarity | NPC322091 |
0.5769 | Remote Similarity | NPC145235 |
0.575 | Remote Similarity | NPC260324 |
0.5741 | Remote Similarity | NPC317147 |
0.5741 | Remote Similarity | NPC318260 |
0.5741 | Remote Similarity | NPC278209 |
0.5714 | Remote Similarity | NPC329564 |
0.5714 | Remote Similarity | NPC327542 |
0.5714 | Remote Similarity | NPC327170 |
0.5714 | Remote Similarity | NPC227850 |
0.5714 | Remote Similarity | NPC318523 |
0.5686 | Remote Similarity | NPC155156 |
0.5686 | Remote Similarity | NPC200550 |
0.5686 | Remote Similarity | NPC322946 |
0.566 | Remote Similarity | NPC10915 |
0.566 | Remote Similarity | NPC322573 |
0.566 | Remote Similarity | NPC327831 |
0.5641 | Remote Similarity | NPC241404 |
0.5636 | Remote Similarity | NPC189301 |
0.5636 | Remote Similarity | NPC176164 |
0.561 | Remote Similarity | NPC307027 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC9294 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 |
---|---|---|---|
0.7838 | Intermediate Similarity | NPD8211 | Approved |
0.7838 | Intermediate Similarity | NPD8210 | Phase 3 |
0.7805 | Intermediate Similarity | NPD8798 | Approved |
0.7561 | Intermediate Similarity | NPD8805 | Approved |
0.7561 | Intermediate Similarity | NPD8804 | Approved |
0.7333 | Intermediate Similarity | NPD8947 | Approved |
0.7333 | Intermediate Similarity | NPD8946 | Approved |
0.7273 | Intermediate Similarity | NPD8850 | Approved |
0.7105 | Intermediate Similarity | NPD9136 | Clinical (unspecified phase) |
0.7045 | Intermediate Similarity | NPD8801 | Approved |
0.6957 | Remote Similarity | NPD9018 | Approved |
0.6957 | Remote Similarity | NPD9017 | Approved |
0.6757 | Remote Similarity | NPD8557 | Approved |
0.6757 | Remote Similarity | NPD8558 | Approved |
0.6667 | Remote Similarity | NPD8982 | Approved |
0.6596 | Remote Similarity | NPD8802 | Approved |
0.6596 | Remote Similarity | NPD8803 | Clinical (unspecified phase) |
0.6596 | Remote Similarity | NPD9016 | Clinical (unspecified phase) |
0.6596 | Remote Similarity | NPD9021 | Approved |
0.6596 | Remote Similarity | NPD8624 | Approved |
0.6585 | Remote Similarity | NPD8623 | Phase 1 |
0.6522 | Remote Similarity | NPD8810 | Clinical (unspecified phase) |
0.6512 | Remote Similarity | NPD8217 | Clinical (unspecified phase) |
0.6512 | Remote Similarity | NPD8214 | Approved |
0.6512 | Remote Similarity | NPD8215 | Approved |
0.6512 | Remote Similarity | NPD8216 | Approved |
0.6444 | Remote Similarity | NPD8610 | Approved |
0.6389 | Remote Similarity | NPD7371 | Approved |
0.6383 | Remote Similarity | NPD8808 | Approved |
0.6383 | Remote Similarity | NPD8614 | Approved |
0.6383 | Remote Similarity | NPD8809 | Approved |
0.6383 | Remote Similarity | NPD8873 | Approved |
0.625 | Remote Similarity | NPD9044 | Approved |
0.6154 | Remote Similarity | NPD8981 | Clinical (unspecified phase) |
0.6154 | Remote Similarity | NPD8979 | Approved |
0.6154 | Remote Similarity | NPD8980 | Approved |
0.6122 | Remote Similarity | NPD8871 | Approved |
0.6122 | Remote Similarity | NPD8872 | Phase 3 |
0.6122 | Remote Similarity | NPD9212 | Clinical (unspecified phase) |
0.6122 | Remote Similarity | NPD9025 | Approved |
0.6061 | Remote Similarity | NPD8201 | Phase 2 |
0.6042 | Remote Similarity | NPD9213 | Approved |
0.6042 | Remote Similarity | NPD9214 | Phase 3 |
0.6 | Remote Similarity | NPD8800 | Approved |
0.5957 | Remote Similarity | NPD8870 | Approved |
0.5957 | Remote Similarity | NPD9020 | Approved |
0.5926 | Remote Similarity | NPD9023 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD8785 | Approved |
0.5882 | Remote Similarity | NPD8851 | Phase 1 |
0.5882 | Remote Similarity | NPD8849 | Clinical (unspecified phase) |
0.587 | Remote Similarity | NPD9019 | Approved |
0.5833 | Remote Similarity | NPD7368 | Approved |
0.5833 | Remote Similarity | NPD8209 | Phase 2 |
0.5833 | Remote Similarity | NPD8208 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD7367 | Approved |
0.5833 | Remote Similarity | NPD51 | Approved |
0.5778 | Remote Similarity | NPD8609 | Approved |
0.5686 | Remote Similarity | NPD9441 | Phase 2 |
0.5636 | Remote Similarity | NPD9433 | Approved |
PubChem CID   | 5245672;6119 |
ChEMBL   | CHEMBL1230906 |
ZINC   |
Molecular Weight:   | 103.06 |
ALogP:   | -0.3956 |
MLogP:   | 1.57 |
XLogP:   | -2.714 |
# Rotatable Bonds:   | 5 |
Polar Surface Area:   | 63.32 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 2 |
# Rings:   | 0 |
# Heavy Atoms:   | 7 |