Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | = | 35500 | nM | 21036050 | |
NPT1 | Others | Radical scavenging activity | IC50 | = | 34700 | nM | DrugMatrix in vitro pharmacology data | |
NPT2 | Others | Unspecified | Activity | = | 3787.8 | mmol/g | 23369536 | |
NPT2 | Others | Unspecified | IC50 | = | 34600 | nM | 15568762 | |
NPT1514 | Uncleic Acid | DNA | Bos taurus | Kb | = | 2.36 | 10'4/M | 18675491 |
NPT2 | Others | Unspecified | Activity | = | 4093.9 | umol/kg | 23398362 | |
NPT2 | Others | Unspecified | Activity | = | 11.9 | mg/kg | 16643023 |
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 NPC41429 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 |
---|---|---|
0.7164 | Intermediate Similarity | NPC314510 |
0.7051 | Intermediate Similarity | NPC314466 |
0.7042 | Intermediate Similarity | NPC195165 |
0.6984 | Remote Similarity | NPC137327 |
0.6883 | Remote Similarity | NPC37681 |
0.6774 | Remote Similarity | NPC80350 |
0.6757 | Remote Similarity | NPC477200 |
0.6716 | Remote Similarity | NPC472578 |
0.6712 | Remote Similarity | NPC472579 |
0.6667 | Remote Similarity | NPC224624 |
0.6618 | Remote Similarity | NPC321468 |
0.6618 | Remote Similarity | NPC327748 |
0.6613 | Remote Similarity | NPC180402 |
0.6613 | Remote Similarity | NPC87359 |
0.6579 | Remote Similarity | NPC476248 |
0.6571 | Remote Similarity | NPC145627 |
0.6522 | Remote Similarity | NPC327170 |
0.6522 | Remote Similarity | NPC329564 |
0.6479 | Remote Similarity | NPC313420 |
0.6406 | Remote Similarity | NPC321394 |
0.6406 | Remote Similarity | NPC326283 |
0.64 | Remote Similarity | NPC476285 |
0.6377 | Remote Similarity | NPC316826 |
0.6377 | Remote Similarity | NPC317143 |
0.6324 | Remote Similarity | NPC317147 |
0.6324 | Remote Similarity | NPC8979 |
0.6234 | Remote Similarity | NPC55274 |
0.6232 | Remote Similarity | NPC204709 |
0.6212 | Remote Similarity | NPC474322 |
0.6203 | Remote Similarity | NPC476130 |
0.6203 | Remote Similarity | NPC476324 |
0.6184 | Remote Similarity | NPC476291 |
0.6154 | Remote Similarity | NPC138435 |
0.6119 | Remote Similarity | NPC270041 |
0.6119 | Remote Similarity | NPC321118 |
0.6119 | Remote Similarity | NPC316889 |
0.6094 | Remote Similarity | NPC29222 |
0.6094 | Remote Similarity | NPC121062 |
0.6094 | Remote Similarity | NPC96966 |
0.6087 | Remote Similarity | NPC311668 |
0.6087 | Remote Similarity | NPC318260 |
0.6087 | Remote Similarity | NPC65832 |
0.6087 | Remote Similarity | NPC10262 |
0.6081 | Remote Similarity | NPC474402 |
0.6049 | Remote Similarity | NPC191774 |
0.6026 | Remote Similarity | NPC141325 |
0.6024 | Remote Similarity | NPC470783 |
0.5974 | Remote Similarity | NPC478256 |
0.5972 | Remote Similarity | NPC474014 |
0.5972 | Remote Similarity | NPC30126 |
0.5972 | Remote Similarity | NPC57846 |
0.597 | Remote Similarity | NPC123814 |
0.5926 | Remote Similarity | NPC472594 |
0.5915 | Remote Similarity | NPC143809 |
0.5915 | Remote Similarity | NPC254541 |
0.5915 | Remote Similarity | NPC76726 |
0.5915 | Remote Similarity | NPC193593 |
0.5915 | Remote Similarity | NPC320598 |
0.5915 | Remote Similarity | NPC476537 |
0.5915 | Remote Similarity | NPC321536 |
0.5915 | Remote Similarity | NPC216415 |
0.5915 | Remote Similarity | NPC290106 |
0.589 | Remote Similarity | NPC17455 |
0.5882 | Remote Similarity | NPC272396 |
0.5875 | Remote Similarity | NPC472595 |
0.5854 | Remote Similarity | NPC316242 |
0.5846 | Remote Similarity | NPC193872 |
0.5844 | Remote Similarity | NPC314273 |
0.5844 | Remote Similarity | NPC268922 |
0.5844 | Remote Similarity | NPC193280 |
0.5823 | Remote Similarity | NPC315897 |
0.5811 | Remote Similarity | NPC315744 |
0.5783 | Remote Similarity | NPC478017 |
0.5783 | Remote Similarity | NPC315535 |
0.5783 | Remote Similarity | NPC312315 |
0.5783 | Remote Similarity | NPC315131 |
0.5775 | Remote Similarity | NPC190385 |
0.5775 | Remote Similarity | NPC328447 |
0.5775 | Remote Similarity | NPC176164 |
0.5775 | Remote Similarity | NPC189301 |
0.5769 | Remote Similarity | NPC327753 |
0.5769 | Remote Similarity | NPC475694 |
0.5769 | Remote Similarity | NPC473710 |
0.5769 | Remote Similarity | NPC327486 |
0.5769 | Remote Similarity | NPC223174 |
0.5765 | Remote Similarity | NPC242077 |
0.5753 | Remote Similarity | NPC62507 |
0.5753 | Remote Similarity | NPC8087 |
0.575 | Remote Similarity | NPC43219 |
0.5747 | Remote Similarity | NPC476523 |
0.5747 | Remote Similarity | NPC477199 |
0.5733 | Remote Similarity | NPC474928 |
0.5714 | Remote Similarity | NPC38463 |
0.5714 | Remote Similarity | NPC471418 |
0.5696 | Remote Similarity | NPC476695 |
0.5696 | Remote Similarity | NPC476694 |
0.5696 | Remote Similarity | NPC476696 |
0.5679 | Remote Similarity | NPC86064 |
0.5676 | Remote Similarity | NPC150680 |
0.5676 | Remote Similarity | NPC69669 |
0.5676 | Remote Similarity | NPC2432 |
0.5676 | Remote Similarity | NPC22774 |
0.5676 | Remote Similarity | NPC218150 |
0.5676 | Remote Similarity | NPC306462 |
0.5667 | Remote Similarity | NPC275715 |
0.5663 | Remote Similarity | NPC325902 |
0.5658 | Remote Similarity | NPC286851 |
0.5658 | Remote Similarity | NPC315980 |
0.5658 | Remote Similarity | NPC303798 |
0.5658 | Remote Similarity | NPC470108 |
0.5657 | Remote Similarity | NPC128303 |
0.5638 | Remote Similarity | NPC330590 |
0.5616 | Remote Similarity | NPC143722 |
0.5616 | Remote Similarity | NPC471129 |
0.561 | Remote Similarity | NPC244539 |
0.561 | Remote Similarity | NPC477002 |
0.561 | Remote Similarity | NPC264417 |
0.561 | Remote Similarity | NPC217095 |
0.5604 | Remote Similarity | NPC477729 |
0.56 | Remote Similarity | NPC241394 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC41429 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 |
---|---|---|---|
0.6857 | Remote Similarity | NPD1831 | Phase 3 |
0.6667 | Remote Similarity | NPD3187 | Discontinued |
0.6452 | Remote Similarity | NPD379 | Clinical (unspecified phase) |
0.6429 | Remote Similarity | NPD9024 | Phase 2 |
0.6429 | Remote Similarity | NPD9022 | Phase 2 |
0.6406 | Remote Similarity | NPD9678 | Approved |
0.6406 | Remote Similarity | NPD9677 | Phase 3 |
0.6349 | Remote Similarity | NPD362 | Phase 1 |
0.6056 | Remote Similarity | NPD9239 | Approved |
0.6056 | Remote Similarity | NPD9240 | Approved |
0.6049 | Remote Similarity | NPD4278 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD3733 | Clinical (unspecified phase) |
0.5974 | Remote Similarity | NPD2702 | Phase 1 |
0.5974 | Remote Similarity | NPD2704 | Phase 3 |
0.597 | Remote Similarity | NPD3215 | Phase 1 |
0.5926 | Remote Similarity | NPD2689 | Clinical (unspecified phase) |
0.5909 | Remote Similarity | NPD3214 | Discontinued |
0.589 | Remote Similarity | NPD5375 | Phase 3 |
0.5833 | Remote Similarity | NPD1155 | Discontinued |
0.5823 | Remote Similarity | NPD1147 | Phase 2 |
0.5823 | Remote Similarity | NPD1825 | Clinical (unspecified phase) |
0.5806 | Remote Similarity | NPD7841 | Clinical (unspecified phase) |
0.5802 | Remote Similarity | NPD1453 | Phase 1 |
0.5797 | Remote Similarity | NPD1830 | Clinical (unspecified phase) |
0.5789 | Remote Similarity | NPD1429 | Clinical (unspecified phase) |
0.5783 | Remote Similarity | NPD7918 | Clinical (unspecified phase) |
0.5783 | Remote Similarity | NPD7917 | Clinical (unspecified phase) |
0.5778 | Remote Similarity | NPD3716 | Discontinued |
0.5775 | Remote Similarity | NPD9023 | Clinical (unspecified phase) |
0.5775 | Remote Similarity | NPD9661 | Approved |
0.5775 | Remote Similarity | NPD9433 | Approved |
0.5769 | Remote Similarity | NPD9445 | Approved |
0.5765 | Remote Similarity | NPD9645 | Approved |
0.5765 | Remote Similarity | NPD9646 | Approved |
0.5765 | Remote Similarity | NPD9644 | Approved |
0.5758 | Remote Similarity | NPD5376 | Approved |
0.5747 | Remote Similarity | NPD9654 | Phase 2 |
0.5745 | Remote Similarity | NPD6428 | Approved |
0.573 | Remote Similarity | NPD3177 | Phase 3 |
0.5696 | Remote Similarity | NPD9446 | Approved |
0.5692 | Remote Similarity | NPD398 | Approved |
0.5692 | Remote Similarity | NPD400 | Approved |
0.5692 | Remote Similarity | NPD399 | Approved |
0.5676 | Remote Similarity | NPD9026 | Phase 2 |
0.5676 | Remote Similarity | NPD9029 | Phase 3 |
0.5676 | Remote Similarity | NPD9027 | Phase 3 |
0.5676 | Remote Similarity | NPD9028 | Phase 2 |
0.5672 | Remote Similarity | NPD903 | Approved |
0.5638 | Remote Similarity | NPD5381 | Approved |
0.5638 | Remote Similarity | NPD5378 | Approved |
0.5638 | Remote Similarity | NPD5377 | Approved |
PubChem CID   | 76317397 |
ChEMBL   | CHEMBL3104963 |
ZINC   |
Molecular Weight:   | 260.18 |
ALogP:   | -1.9358 |
MLogP:   | 1.9 |
XLogP:   | -0.452 |
# Rotatable Bonds:   | 15 |
Polar Surface Area:   | 148.94 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 6 |
# Rings:   | 0 |
# Heavy Atoms:   | 18 |