Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT1726 | Organism | Vibrio harveyi | Vibrio harveyi | IZ | = | 12.9 | mm | DrugMatrix in vitro pharmacology data |
NPT1726 | Organism | Vibrio harveyi | Vibrio harveyi | MIC | = | 50 | ug/ml | DrugMatrix in vitro pharmacology data |
NPT565 | Organism | Vibrio parahaemolyticus | Vibrio parahaemolyticus | IZ | = | 12.68 | mm | DrugMatrix in vitro pharmacology data |
NPT565 | Organism | Vibrio parahaemolyticus | Vibrio parahaemolyticus | IZ | = | 12.9 | mm | DrugMatrix in vitro pharmacology data |
NPT1726 | Organism | Vibrio harveyi | Vibrio harveyi | IZ | = | 11.65 | mm | DrugMatrix in vitro pharmacology data |
NPT565 | Organism | Vibrio parahaemolyticus | Vibrio parahaemolyticus | IZ | = | 13.2 | mm | DrugMatrix in vitro pharmacology data |
NPT565 | Organism | Vibrio parahaemolyticus | Vibrio parahaemolyticus | MIC | = | 35 | ug/ml | 21954912 |
NPT5711 | Organism | Vibrio vulnificus | Vibrio vulnificus | IZ | = | 12 | mm | 14613312 |
NPT5711 | Organism | Vibrio vulnificus | Vibrio vulnificus | IZ | = | 11.7 | mm | 14613312 |
NPT5711 | Organism | Vibrio vulnificus | Vibrio vulnificus | IZ | = | 12.4 | mm | 14613312 |
NPT1726 | Organism | Vibrio harveyi | Vibrio harveyi | IZ | = | 10.58 | mm | 10.6019/CHEMBL1201861 |
NPT5711 | Organism | Vibrio vulnificus | Vibrio vulnificus | MIC | = | 40 | ug/ml | 9599261 |
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 NPC10017 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 |
---|---|---|
0.8983 | High Similarity | NPC133368 |
0.8983 | High Similarity | NPC211291 |
0.8596 | High Similarity | NPC274396 |
0.8065 | Intermediate Similarity | NPC279200 |
0.8 | Intermediate Similarity | NPC475830 |
0.7969 | Intermediate Similarity | NPC162309 |
0.7969 | Intermediate Similarity | NPC272125 |
0.7937 | Intermediate Similarity | NPC309300 |
0.7937 | Intermediate Similarity | NPC469723 |
0.7846 | Intermediate Similarity | NPC472253 |
0.7846 | Intermediate Similarity | NPC472255 |
0.7846 | Intermediate Similarity | NPC136813 |
0.7846 | Intermediate Similarity | NPC477791 |
0.7812 | Intermediate Similarity | NPC477009 |
0.7812 | Intermediate Similarity | NPC19569 |
0.7812 | Intermediate Similarity | NPC238352 |
0.7742 | Intermediate Similarity | NPC323153 |
0.7727 | Intermediate Similarity | NPC167527 |
0.7692 | Intermediate Similarity | NPC149680 |
0.7656 | Intermediate Similarity | NPC225415 |
0.7656 | Intermediate Similarity | NPC110241 |
0.7647 | Intermediate Similarity | NPC471662 |
0.7627 | Intermediate Similarity | NPC286752 |
0.7619 | Intermediate Similarity | NPC274704 |
0.7619 | Intermediate Similarity | NPC225342 |
0.7581 | Intermediate Similarity | NPC5698 |
0.7576 | Intermediate Similarity | NPC197805 |
0.7541 | Intermediate Similarity | NPC278550 |
0.7538 | Intermediate Similarity | NPC61503 |
0.75 | Intermediate Similarity | NPC473759 |
0.75 | Intermediate Similarity | NPC470041 |
0.75 | Intermediate Similarity | NPC474155 |
0.7465 | Intermediate Similarity | NPC471658 |
0.7463 | Intermediate Similarity | NPC160209 |
0.7463 | Intermediate Similarity | NPC471238 |
0.746 | Intermediate Similarity | NPC135648 |
0.7458 | Intermediate Similarity | NPC192962 |
0.7455 | Intermediate Similarity | NPC24824 |
0.7455 | Intermediate Similarity | NPC210560 |
0.7455 | Intermediate Similarity | NPC165651 |
0.7455 | Intermediate Similarity | NPC87439 |
0.7429 | Intermediate Similarity | NPC471659 |
0.7424 | Intermediate Similarity | NPC286669 |
0.7424 | Intermediate Similarity | NPC222366 |
0.7424 | Intermediate Similarity | NPC476039 |
0.7407 | Intermediate Similarity | NPC252978 |
0.7385 | Intermediate Similarity | NPC290367 |
0.7385 | Intermediate Similarity | NPC107540 |
0.7385 | Intermediate Similarity | NPC300593 |
0.7368 | Intermediate Similarity | NPC62755 |
0.7353 | Intermediate Similarity | NPC471560 |
0.7353 | Intermediate Similarity | NPC217570 |
0.7353 | Intermediate Similarity | NPC90115 |
0.7344 | Intermediate Similarity | NPC210346 |
0.7313 | Intermediate Similarity | NPC68703 |
0.7313 | Intermediate Similarity | NPC171225 |
0.7313 | Intermediate Similarity | NPC69649 |
0.7286 | Intermediate Similarity | NPC474743 |
0.7273 | Intermediate Similarity | NPC163678 |
0.7246 | Intermediate Similarity | NPC145498 |
0.7213 | Intermediate Similarity | NPC130209 |
0.7213 | Intermediate Similarity | NPC148163 |
0.7213 | Intermediate Similarity | NPC298299 |
0.7213 | Intermediate Similarity | NPC148216 |
0.7206 | Intermediate Similarity | NPC208999 |
0.7206 | Intermediate Similarity | NPC216460 |
0.7206 | Intermediate Similarity | NPC96484 |
0.7206 | Intermediate Similarity | NPC32055 |
0.7188 | Intermediate Similarity | NPC66020 |
0.7188 | Intermediate Similarity | NPC471081 |
0.7188 | Intermediate Similarity | NPC252809 |
0.7164 | Intermediate Similarity | NPC267027 |
0.7143 | Intermediate Similarity | NPC471660 |
0.7143 | Intermediate Similarity | NPC242001 |
0.7143 | Intermediate Similarity | NPC471268 |
0.7143 | Intermediate Similarity | NPC471272 |
0.7143 | Intermediate Similarity | NPC471271 |
0.7143 | Intermediate Similarity | NPC76976 |
0.7143 | Intermediate Similarity | NPC477792 |
0.7143 | Intermediate Similarity | NPC41886 |
0.7123 | Intermediate Similarity | NPC471454 |
0.7123 | Intermediate Similarity | NPC31037 |
0.7101 | Intermediate Similarity | NPC474248 |
0.7097 | Intermediate Similarity | NPC39068 |
0.7083 | Intermediate Similarity | NPC60818 |
0.7083 | Intermediate Similarity | NPC23231 |
0.7083 | Intermediate Similarity | NPC471468 |
0.7077 | Intermediate Similarity | NPC147524 |
0.7077 | Intermediate Similarity | NPC475251 |
0.7059 | Intermediate Similarity | NPC114651 |
0.7042 | Intermediate Similarity | NPC68443 |
0.7042 | Intermediate Similarity | NPC182717 |
0.7042 | Intermediate Similarity | NPC14352 |
0.7042 | Intermediate Similarity | NPC474140 |
0.7042 | Intermediate Similarity | NPC471799 |
0.7042 | Intermediate Similarity | NPC234527 |
0.7031 | Intermediate Similarity | NPC99480 |
0.7031 | Intermediate Similarity | NPC122239 |
0.7031 | Intermediate Similarity | NPC469321 |
0.7031 | Intermediate Similarity | NPC184049 |
0.7027 | Intermediate Similarity | NPC11908 |
0.7015 | Intermediate Similarity | NPC471200 |
0.7015 | Intermediate Similarity | NPC187619 |
0.7 | Intermediate Similarity | NPC34834 |
0.7 | Intermediate Similarity | NPC92801 |
0.7 | Intermediate Similarity | NPC35519 |
0.7 | Intermediate Similarity | NPC49422 |
0.7 | Intermediate Similarity | NPC9161 |
0.7 | Intermediate Similarity | NPC181255 |
0.7 | Intermediate Similarity | NPC306195 |
0.7 | Intermediate Similarity | NPC157781 |
0.7 | Intermediate Similarity | NPC471781 |
0.7 | Intermediate Similarity | NPC179169 |
0.6986 | Remote Similarity | NPC134330 |
0.6986 | Remote Similarity | NPC113733 |
0.6986 | Remote Similarity | NPC126969 |
0.6986 | Remote Similarity | NPC129165 |
0.6986 | Remote Similarity | NPC310643 |
0.6986 | Remote Similarity | NPC470362 |
0.697 | Remote Similarity | NPC474480 |
0.697 | Remote Similarity | NPC473508 |
0.6957 | Remote Similarity | NPC470040 |
0.6949 | Remote Similarity | NPC329773 |
0.6944 | Remote Similarity | NPC477138 |
0.6944 | Remote Similarity | NPC243342 |
0.6944 | Remote Similarity | NPC309178 |
0.6944 | Remote Similarity | NPC27395 |
0.6944 | Remote Similarity | NPC329090 |
0.6944 | Remote Similarity | NPC91858 |
0.6944 | Remote Similarity | NPC471797 |
0.6935 | Remote Similarity | NPC218525 |
0.6923 | Remote Similarity | NPC240506 |
0.6923 | Remote Similarity | NPC47840 |
0.6923 | Remote Similarity | NPC99487 |
0.6923 | Remote Similarity | NPC234264 |
0.6912 | Remote Similarity | NPC279434 |
0.6912 | Remote Similarity | NPC476406 |
0.6912 | Remote Similarity | NPC202017 |
0.6901 | Remote Similarity | NPC167706 |
0.6901 | Remote Similarity | NPC110799 |
0.6901 | Remote Similarity | NPC164022 |
0.6892 | Remote Similarity | NPC472805 |
0.6892 | Remote Similarity | NPC90979 |
0.6875 | Remote Similarity | NPC155025 |
0.6866 | Remote Similarity | NPC140233 |
0.6866 | Remote Similarity | NPC219940 |
0.6866 | Remote Similarity | NPC287744 |
0.6866 | Remote Similarity | NPC96793 |
0.6866 | Remote Similarity | NPC323424 |
0.6857 | Remote Similarity | NPC473893 |
0.6857 | Remote Similarity | NPC167272 |
0.6857 | Remote Similarity | NPC269877 |
0.6849 | Remote Similarity | NPC313185 |
0.6849 | Remote Similarity | NPC291503 |
0.6849 | Remote Similarity | NPC136188 |
0.6849 | Remote Similarity | NPC471723 |
0.6849 | Remote Similarity | NPC288035 |
0.6849 | Remote Similarity | NPC28657 |
0.6849 | Remote Similarity | NPC319090 |
0.6849 | Remote Similarity | NPC22105 |
0.6849 | Remote Similarity | NPC141071 |
0.6849 | Remote Similarity | NPC285893 |
0.6849 | Remote Similarity | NPC162742 |
0.6849 | Remote Similarity | NPC257347 |
0.6849 | Remote Similarity | NPC230301 |
0.6849 | Remote Similarity | NPC113639 |
0.6849 | Remote Similarity | NPC304309 |
0.6849 | Remote Similarity | NPC134847 |
0.6849 | Remote Similarity | NPC328104 |
0.6842 | Remote Similarity | NPC471656 |
0.6833 | Remote Similarity | NPC26906 |
0.6833 | Remote Similarity | NPC214584 |
0.6825 | Remote Similarity | NPC179024 |
0.6825 | Remote Similarity | NPC48891 |
0.6818 | Remote Similarity | NPC63111 |
0.6812 | Remote Similarity | NPC476650 |
0.6806 | Remote Similarity | NPC130665 |
0.6806 | Remote Similarity | NPC329763 |
0.68 | Remote Similarity | NPC318136 |
0.68 | Remote Similarity | NPC76931 |
0.68 | Remote Similarity | NPC18603 |
0.68 | Remote Similarity | NPC148977 |
0.68 | Remote Similarity | NPC307965 |
0.68 | Remote Similarity | NPC312328 |
0.6786 | Remote Similarity | NPC15162 |
0.6786 | Remote Similarity | NPC269862 |
0.6769 | Remote Similarity | NPC475931 |
0.6769 | Remote Similarity | NPC309825 |
0.6765 | Remote Similarity | NPC261782 |
0.6765 | Remote Similarity | NPC300442 |
0.6765 | Remote Similarity | NPC308844 |
0.6765 | Remote Similarity | NPC27243 |
0.6765 | Remote Similarity | NPC469326 |
0.6765 | Remote Similarity | NPC476737 |
0.6765 | Remote Similarity | NPC474329 |
0.6765 | Remote Similarity | NPC474304 |
0.6765 | Remote Similarity | NPC205618 |
0.6761 | Remote Similarity | NPC254845 |
0.6761 | Remote Similarity | NPC475728 |
0.6761 | Remote Similarity | NPC280256 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC10017 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 |
---|---|---|---|
0.7213 | Intermediate Similarity | NPD342 | Phase 1 |
0.7 | Intermediate Similarity | NPD7144 | Approved |
0.7 | Intermediate Similarity | NPD7143 | Approved |
0.6944 | Remote Similarity | NPD6926 | Approved |
0.6944 | Remote Similarity | NPD6924 | Approved |
0.6901 | Remote Similarity | NPD7150 | Approved |
0.6901 | Remote Similarity | NPD7151 | Approved |
0.6901 | Remote Similarity | NPD7152 | Approved |
0.6857 | Remote Similarity | NPD6922 | Approved |
0.6857 | Remote Similarity | NPD6923 | Approved |
0.6849 | Remote Similarity | NPD7339 | Approved |
0.6849 | Remote Similarity | NPD6942 | Approved |
0.6757 | Remote Similarity | NPD6933 | Approved |
0.6757 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6623 | Remote Similarity | NPD7509 | Discontinued |
0.6579 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.6567 | Remote Similarity | NPD368 | Approved |
0.6562 | Remote Similarity | NPD4219 | Approved |
0.6494 | Remote Similarity | NPD6929 | Approved |
0.6486 | Remote Similarity | NPD4785 | Approved |
0.6486 | Remote Similarity | NPD4784 | Approved |
0.6447 | Remote Similarity | NPD6932 | Approved |
0.6438 | Remote Similarity | NPD4243 | Approved |
0.641 | Remote Similarity | NPD6931 | Approved |
0.641 | Remote Similarity | NPD7525 | Registered |
0.641 | Remote Similarity | NPD7332 | Phase 2 |
0.641 | Remote Similarity | NPD6930 | Phase 2 |
0.64 | Remote Similarity | NPD8264 | Approved |
0.6364 | Remote Similarity | NPD7145 | Approved |
0.6364 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6282 | Remote Similarity | NPD7645 | Phase 2 |
0.625 | Remote Similarity | NPD3667 | Approved |
0.6234 | Remote Similarity | NPD6925 | Approved |
0.6234 | Remote Similarity | NPD5776 | Phase 2 |
0.6203 | Remote Similarity | NPD7514 | Phase 3 |
0.6184 | Remote Similarity | NPD4190 | Phase 3 |
0.6184 | Remote Similarity | NPD5275 | Approved |
0.6173 | Remote Similarity | NPD6695 | Phase 3 |
0.6136 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.6125 | Remote Similarity | NPD6898 | Phase 1 |
0.6125 | Remote Similarity | NPD6902 | Approved |
0.6098 | Remote Similarity | NPD3133 | Approved |
0.6098 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6098 | Remote Similarity | NPD4786 | Approved |
0.6098 | Remote Similarity | NPD3666 | Approved |
0.6098 | Remote Similarity | NPD3665 | Phase 1 |
0.6076 | Remote Similarity | NPD4195 | Approved |
0.6076 | Remote Similarity | NPD6683 | Phase 2 |
0.6024 | Remote Similarity | NPD6893 | Approved |
0.6 | Remote Similarity | NPD4821 | Approved |
0.6 | Remote Similarity | NPD5368 | Approved |
0.6 | Remote Similarity | NPD4819 | Approved |
0.6 | Remote Similarity | NPD4822 | Approved |
0.6 | Remote Similarity | NPD4820 | Approved |
0.5976 | Remote Similarity | NPD5362 | Discontinued |
0.5952 | Remote Similarity | NPD3618 | Phase 1 |
0.5952 | Remote Similarity | NPD5279 | Phase 3 |
0.5949 | Remote Similarity | NPD4268 | Approved |
0.5949 | Remote Similarity | NPD4271 | Approved |
0.5946 | Remote Similarity | NPD1082 | Approved |
0.5926 | Remote Similarity | NPD857 | Phase 3 |
0.5926 | Remote Similarity | NPD5369 | Approved |
0.5902 | Remote Similarity | NPD385 | Approved |
0.5902 | Remote Similarity | NPD384 | Approved |
0.5897 | Remote Similarity | NPD1346 | Approved |
0.5882 | Remote Similarity | NPD7750 | Discontinued |
0.5882 | Remote Similarity | NPD7524 | Approved |
0.5882 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.5854 | Remote Similarity | NPD4270 | Approved |
0.5854 | Remote Similarity | NPD6435 | Approved |
0.5854 | Remote Similarity | NPD4269 | Approved |
0.5802 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5802 | Remote Similarity | NPD4748 | Discontinued |
0.5795 | Remote Similarity | NPD6079 | Approved |
0.5783 | Remote Similarity | NPD5331 | Approved |
0.5783 | Remote Similarity | NPD7154 | Phase 3 |
0.5783 | Remote Similarity | NPD5332 | Approved |
0.5765 | Remote Similarity | NPD4519 | Discontinued |
0.5765 | Remote Similarity | NPD4623 | Approved |
0.5747 | Remote Similarity | NPD4753 | Phase 2 |
0.5747 | Remote Similarity | NPD5328 | Approved |
0.5738 | Remote Similarity | NPD4265 | Approved |
0.5733 | Remote Similarity | NPD791 | Approved |
0.5733 | Remote Similarity | NPD15 | Approved |
0.5732 | Remote Similarity | NPD4790 | Discontinued |
0.5714 | Remote Similarity | NPD4732 | Discontinued |
0.5682 | Remote Similarity | NPD5785 | Approved |
0.5682 | Remote Similarity | NPD7136 | Phase 2 |
0.5667 | Remote Similarity | NPD5282 | Discontinued |
0.5663 | Remote Similarity | NPD4221 | Approved |
0.5663 | Remote Similarity | NPD4223 | Phase 3 |
0.5647 | Remote Similarity | NPD1696 | Phase 3 |
0.5647 | Remote Similarity | NPD5363 | Approved |
0.5634 | Remote Similarity | NPD834 | Approved |
0.5634 | Remote Similarity | NPD835 | Approved |
0.5618 | Remote Similarity | NPD7087 | Discontinued |
0.5618 | Remote Similarity | NPD6411 | Approved |
0.561 | Remote Similarity | NPD4695 | Discontinued |
0.561 | Remote Similarity | NPD4252 | Approved |
0.5606 | Remote Similarity | NPD3172 | Approved |
0.5604 | Remote Similarity | NPD5210 | Approved |
0.5604 | Remote Similarity | NPD4629 | Approved |
PubChem CID   | 46703006 |
ChEMBL   | CHEMBL1164833 |
ZINC   |
Molecular Weight:   | 222.20 |
ALogP:   | -0.2533 |
MLogP:   | 3 |
XLogP:   | 5.216 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 2 |
# Heavy Atoms:   | 16 |