Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | Ratio IC50 | = | 210 | DrugMatrix in vivo data: Pathology | ||
NPT2 | Others | Unspecified | Ratio IC50 | = | 640 | 24754786 | ||
NPT91 | Cell Line | KB | Homo sapiens | IC50 | = | 19.1 | ug/ml | 17178800 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.0297 | ug/ml | 17844994 |
NPT6 | Organism | Plasmodium falciparum | Plasmodium falciparum | IC50 | = | 0.09 | ug/ml | 19053514 |
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 NPC474086 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 |
---|---|---|
0.8833 | High Similarity | NPC475716 |
0.85 | High Similarity | NPC474528 |
0.85 | High Similarity | NPC474415 |
0.85 | High Similarity | NPC475696 |
0.85 | High Similarity | NPC474457 |
0.8448 | Intermediate Similarity | NPC476679 |
0.8226 | Intermediate Similarity | NPC474454 |
0.8226 | Intermediate Similarity | NPC474455 |
0.8226 | Intermediate Similarity | NPC474420 |
0.8065 | Intermediate Similarity | NPC469769 |
0.7931 | Intermediate Similarity | NPC476681 |
0.7833 | Intermediate Similarity | NPC474416 |
0.7458 | Intermediate Similarity | NPC22765 |
0.7302 | Intermediate Similarity | NPC470893 |
0.7302 | Intermediate Similarity | NPC123194 |
0.7288 | Intermediate Similarity | NPC124851 |
0.7167 | Intermediate Similarity | NPC17518 |
0.7121 | Intermediate Similarity | NPC472827 |
0.7119 | Intermediate Similarity | NPC323445 |
0.7049 | Intermediate Similarity | NPC200129 |
0.7 | Intermediate Similarity | NPC92327 |
0.6986 | Remote Similarity | NPC470078 |
0.6986 | Remote Similarity | NPC21773 |
0.6984 | Remote Similarity | NPC127944 |
0.6949 | Remote Similarity | NPC86683 |
0.6949 | Remote Similarity | NPC49088 |
0.6933 | Remote Similarity | NPC125828 |
0.6912 | Remote Similarity | NPC219621 |
0.6901 | Remote Similarity | NPC176107 |
0.68 | Remote Similarity | NPC476904 |
0.6769 | Remote Similarity | NPC469770 |
0.6765 | Remote Similarity | NPC317778 |
0.6761 | Remote Similarity | NPC176171 |
0.6757 | Remote Similarity | NPC265789 |
0.6724 | Remote Similarity | NPC193180 |
0.6724 | Remote Similarity | NPC190232 |
0.6724 | Remote Similarity | NPC105246 |
0.6716 | Remote Similarity | NPC472830 |
0.6712 | Remote Similarity | NPC182815 |
0.6667 | Remote Similarity | NPC469728 |
0.6623 | Remote Similarity | NPC7214 |
0.6622 | Remote Similarity | NPC475728 |
0.6622 | Remote Similarity | NPC9161 |
0.6622 | Remote Similarity | NPC49422 |
0.6613 | Remote Similarity | NPC17810 |
0.661 | Remote Similarity | NPC192529 |
0.6579 | Remote Similarity | NPC329866 |
0.6579 | Remote Similarity | NPC474796 |
0.6579 | Remote Similarity | NPC474797 |
0.6575 | Remote Similarity | NPC160209 |
0.6575 | Remote Similarity | NPC20610 |
0.6552 | Remote Similarity | NPC103290 |
0.6533 | Remote Similarity | NPC115023 |
0.6528 | Remote Similarity | NPC474456 |
0.6528 | Remote Similarity | NPC323005 |
0.6522 | Remote Similarity | NPC311809 |
0.6522 | Remote Similarity | NPC176621 |
0.65 | Remote Similarity | NPC202189 |
0.6494 | Remote Similarity | NPC471468 |
0.6486 | Remote Similarity | NPC269877 |
0.6486 | Remote Similarity | NPC167272 |
0.6471 | Remote Similarity | NPC60772 |
0.6456 | Remote Similarity | NPC18603 |
0.6456 | Remote Similarity | NPC307965 |
0.6456 | Remote Similarity | NPC76931 |
0.6452 | Remote Similarity | NPC178644 |
0.6447 | Remote Similarity | NPC251705 |
0.6441 | Remote Similarity | NPC177470 |
0.641 | Remote Similarity | NPC469793 |
0.641 | Remote Similarity | NPC469796 |
0.64 | Remote Similarity | NPC159577 |
0.64 | Remote Similarity | NPC477856 |
0.64 | Remote Similarity | NPC35734 |
0.64 | Remote Similarity | NPC307176 |
0.64 | Remote Similarity | NPC282593 |
0.64 | Remote Similarity | NPC40574 |
0.64 | Remote Similarity | NPC214770 |
0.6393 | Remote Similarity | NPC296337 |
0.6393 | Remote Similarity | NPC13991 |
0.6393 | Remote Similarity | NPC241784 |
0.6393 | Remote Similarity | NPC114239 |
0.6389 | Remote Similarity | NPC268039 |
0.6377 | Remote Similarity | NPC309825 |
0.6364 | Remote Similarity | NPC476683 |
0.6333 | Remote Similarity | NPC227670 |
0.6333 | Remote Similarity | NPC166362 |
0.6333 | Remote Similarity | NPC141777 |
0.6324 | Remote Similarity | NPC470370 |
0.6324 | Remote Similarity | NPC470369 |
0.6316 | Remote Similarity | NPC234707 |
0.6316 | Remote Similarity | NPC54123 |
0.6301 | Remote Similarity | NPC149680 |
0.6301 | Remote Similarity | NPC37792 |
0.6296 | Remote Similarity | NPC12035 |
0.6282 | Remote Similarity | NPC293803 |
0.6282 | Remote Similarity | NPC473171 |
0.6271 | Remote Similarity | NPC144023 |
0.6267 | Remote Similarity | NPC139397 |
0.6267 | Remote Similarity | NPC184919 |
0.6267 | Remote Similarity | NPC138409 |
0.6267 | Remote Similarity | NPC476431 |
0.625 | Remote Similarity | NPC469662 |
0.625 | Remote Similarity | NPC473959 |
0.6234 | Remote Similarity | NPC470044 |
0.6234 | Remote Similarity | NPC474228 |
0.6234 | Remote Similarity | NPC470045 |
0.6234 | Remote Similarity | NPC303613 |
0.623 | Remote Similarity | NPC248411 |
0.622 | Remote Similarity | NPC118329 |
0.622 | Remote Similarity | NPC152039 |
0.622 | Remote Similarity | NPC329782 |
0.622 | Remote Similarity | NPC474122 |
0.6203 | Remote Similarity | NPC129165 |
0.6203 | Remote Similarity | NPC134330 |
0.6203 | Remote Similarity | NPC474463 |
0.6203 | Remote Similarity | NPC69408 |
0.6203 | Remote Similarity | NPC113733 |
0.6184 | Remote Similarity | NPC2634 |
0.6184 | Remote Similarity | NPC260040 |
0.6184 | Remote Similarity | NPC251929 |
0.6184 | Remote Similarity | NPC265782 |
0.6176 | Remote Similarity | NPC318036 |
0.6173 | Remote Similarity | NPC211322 |
0.6167 | Remote Similarity | NPC473912 |
0.6154 | Remote Similarity | NPC309852 |
0.6154 | Remote Similarity | NPC329090 |
0.6154 | Remote Similarity | NPC27395 |
0.6145 | Remote Similarity | NPC283277 |
0.6145 | Remote Similarity | NPC215474 |
0.6145 | Remote Similarity | NPC472312 |
0.6143 | Remote Similarity | NPC152211 |
0.6143 | Remote Similarity | NPC28755 |
0.6133 | Remote Similarity | NPC32055 |
0.6129 | Remote Similarity | NPC229403 |
0.6125 | Remote Similarity | NPC474230 |
0.6125 | Remote Similarity | NPC91665 |
0.6111 | Remote Similarity | NPC145715 |
0.6111 | Remote Similarity | NPC202118 |
0.6111 | Remote Similarity | NPC197238 |
0.6104 | Remote Similarity | NPC305501 |
0.6102 | Remote Similarity | NPC183670 |
0.6087 | Remote Similarity | NPC173815 |
0.6081 | Remote Similarity | NPC222366 |
0.6081 | Remote Similarity | NPC476039 |
0.6081 | Remote Similarity | NPC286669 |
0.6076 | Remote Similarity | NPC141071 |
0.6076 | Remote Similarity | NPC285893 |
0.6076 | Remote Similarity | NPC288035 |
0.6076 | Remote Similarity | NPC471723 |
0.6076 | Remote Similarity | NPC136188 |
0.6076 | Remote Similarity | NPC22105 |
0.6076 | Remote Similarity | NPC304309 |
0.6076 | Remote Similarity | NPC328104 |
0.6076 | Remote Similarity | NPC319090 |
0.6076 | Remote Similarity | NPC28657 |
0.6076 | Remote Similarity | NPC230301 |
0.6076 | Remote Similarity | NPC257347 |
0.6076 | Remote Similarity | NPC255650 |
0.6076 | Remote Similarity | NPC134847 |
0.6076 | Remote Similarity | NPC162742 |
0.6071 | Remote Similarity | NPC171639 |
0.6071 | Remote Similarity | NPC21667 |
0.6061 | Remote Similarity | NPC473728 |
0.6053 | Remote Similarity | NPC472831 |
0.6049 | Remote Similarity | NPC82635 |
0.6049 | Remote Similarity | NPC186191 |
0.6049 | Remote Similarity | NPC205455 |
0.6049 | Remote Similarity | NPC470052 |
0.6049 | Remote Similarity | NPC105197 |
0.6026 | Remote Similarity | NPC474140 |
0.6 | Remote Similarity | NPC300324 |
0.6 | Remote Similarity | NPC324944 |
0.6 | Remote Similarity | NPC120926 |
0.6 | Remote Similarity | NPC247325 |
0.6 | Remote Similarity | NPC244488 |
0.6 | Remote Similarity | NPC259989 |
0.6 | Remote Similarity | NPC321016 |
0.6 | Remote Similarity | NPC237460 |
0.6 | Remote Similarity | NPC240604 |
0.6 | Remote Similarity | NPC321381 |
0.6 | Remote Similarity | NPC474231 |
0.6 | Remote Similarity | NPC477289 |
0.6 | Remote Similarity | NPC470362 |
0.6 | Remote Similarity | NPC174803 |
0.6 | Remote Similarity | NPC189883 |
0.6 | Remote Similarity | NPC193770 |
0.6 | Remote Similarity | NPC315261 |
0.6 | Remote Similarity | NPC107059 |
0.6 | Remote Similarity | NPC197805 |
0.6 | Remote Similarity | NPC218918 |
0.5976 | Remote Similarity | NPC190211 |
0.5976 | Remote Similarity | NPC170793 |
0.597 | Remote Similarity | NPC472828 |
0.5952 | Remote Similarity | NPC469804 |
0.5952 | Remote Similarity | NPC469805 |
0.5952 | Remote Similarity | NPC469799 |
0.5952 | Remote Similarity | NPC469806 |
0.5949 | Remote Similarity | NPC255021 |
0.593 | Remote Similarity | NPC75810 |
0.593 | Remote Similarity | NPC24733 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC474086 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 |
---|---|---|---|
0.7083 | Intermediate Similarity | NPD6939 | Phase 2 |
0.7083 | Intermediate Similarity | NPD6938 | Clinical (unspecified phase) |
0.6724 | Remote Similarity | NPD1799 | Clinical (unspecified phase) |
0.6622 | Remote Similarity | NPD7144 | Approved |
0.6622 | Remote Similarity | NPD7143 | Approved |
0.6613 | Remote Similarity | NPD8262 | Approved |
0.6579 | Remote Similarity | NPD4687 | Approved |
0.6579 | Remote Similarity | NPD4058 | Approved |
0.6533 | Remote Similarity | NPD7150 | Approved |
0.6533 | Remote Similarity | NPD7152 | Approved |
0.6533 | Remote Similarity | NPD7151 | Approved |
0.6486 | Remote Similarity | NPD6923 | Approved |
0.6486 | Remote Similarity | NPD6922 | Approved |
0.64 | Remote Similarity | NPD4747 | Approved |
0.6364 | Remote Similarity | NPD5733 | Approved |
0.6364 | Remote Similarity | NPD4784 | Approved |
0.6364 | Remote Similarity | NPD4785 | Approved |
0.6351 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6322 | Remote Similarity | NPD4096 | Approved |
0.6316 | Remote Similarity | NPD5276 | Approved |
0.6316 | Remote Similarity | NPD4243 | Approved |
0.6267 | Remote Similarity | NPD4137 | Phase 3 |
0.6265 | Remote Similarity | NPD3527 | Clinical (unspecified phase) |
0.6184 | Remote Similarity | NPD4691 | Approved |
0.6154 | Remote Similarity | NPD6924 | Approved |
0.6154 | Remote Similarity | NPD6926 | Approved |
0.6125 | Remote Similarity | NPD6932 | Approved |
0.6076 | Remote Similarity | NPD6942 | Approved |
0.6076 | Remote Similarity | NPD5275 | Approved |
0.6076 | Remote Similarity | NPD7339 | Approved |
0.6076 | Remote Similarity | NPD4190 | Phase 3 |
0.6049 | Remote Similarity | NPD7145 | Approved |
0.6024 | Remote Similarity | NPD8028 | Phase 2 |
0.6 | Remote Similarity | NPD6933 | Approved |
0.5976 | Remote Similarity | NPD4195 | Approved |
0.5926 | Remote Similarity | NPD5776 | Phase 2 |
0.5926 | Remote Similarity | NPD6925 | Approved |
0.5904 | Remote Similarity | NPD7514 | Phase 3 |
0.5854 | Remote Similarity | NPD7322 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD6902 | Approved |
0.5802 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.5783 | Remote Similarity | NPD6683 | Phase 2 |
0.5783 | Remote Similarity | NPD6929 | Approved |
0.573 | Remote Similarity | NPD5675 | Discontinued |
0.573 | Remote Similarity | NPD4723 | Approved |
0.573 | Remote Similarity | NPD4722 | Approved |
0.5714 | Remote Similarity | NPD7332 | Phase 2 |
0.5714 | Remote Similarity | NPD6930 | Phase 2 |
0.5714 | Remote Similarity | NPD4219 | Approved |
0.5714 | Remote Similarity | NPD6931 | Approved |
0.5714 | Remote Similarity | NPD7525 | Registered |
0.5632 | Remote Similarity | NPD4544 | Approved |
PubChem CID   | 44566852 |
ChEMBL   | CHEMBL460756 |
ZINC   |
Molecular Weight:   | 297.25 |
ALogP:   | 2.5047 |
MLogP:   | 3.66 |
XLogP:   | 7.348 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 23.79 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 3 |
# Heavy Atoms:   | 22 |