Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT202 | Individual Protein | Protease | Human immunodeficiency virus 1 | Inhibition | = | 34 | % | 10.6019/CHEMBL1201861 |
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 NPC97918 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 |
---|---|---|
1.0 | High Similarity | NPC1314 |
1.0 | High Similarity | NPC269484 |
1.0 | High Similarity | NPC305793 |
1.0 | High Similarity | NPC107536 |
1.0 | High Similarity | NPC470518 |
1.0 | High Similarity | NPC141600 |
1.0 | High Similarity | NPC88311 |
1.0 | High Similarity | NPC472267 |
1.0 | High Similarity | NPC244296 |
1.0 | High Similarity | NPC273878 |
1.0 | High Similarity | NPC280029 |
1.0 | High Similarity | NPC11577 |
1.0 | High Similarity | NPC252289 |
1.0 | High Similarity | NPC82380 |
1.0 | High Similarity | NPC9470 |
1.0 | High Similarity | NPC252657 |
1.0 | High Similarity | NPC115656 |
0.9916 | High Similarity | NPC271610 |
0.9916 | High Similarity | NPC476780 |
0.9916 | High Similarity | NPC476774 |
0.9916 | High Similarity | NPC476775 |
0.9915 | High Similarity | NPC477192 |
0.9915 | High Similarity | NPC477191 |
0.9915 | High Similarity | NPC477193 |
0.9915 | High Similarity | NPC477194 |
0.9833 | High Similarity | NPC71391 |
0.9833 | High Similarity | NPC30279 |
0.9833 | High Similarity | NPC476776 |
0.9833 | High Similarity | NPC277212 |
0.9833 | High Similarity | NPC46823 |
0.9833 | High Similarity | NPC178264 |
0.9833 | High Similarity | NPC312650 |
0.9833 | High Similarity | NPC473918 |
0.9833 | High Similarity | NPC192765 |
0.9832 | High Similarity | NPC265841 |
0.9832 | High Similarity | NPC470913 |
0.9832 | High Similarity | NPC470912 |
0.9832 | High Similarity | NPC477196 |
0.9832 | High Similarity | NPC477076 |
0.9832 | High Similarity | NPC47995 |
0.9832 | High Similarity | NPC477079 |
0.9832 | High Similarity | NPC477077 |
0.9752 | High Similarity | NPC225791 |
0.975 | High Similarity | NPC477197 |
0.975 | High Similarity | NPC478155 |
0.975 | High Similarity | NPC25998 |
0.9748 | High Similarity | NPC475281 |
0.9748 | High Similarity | NPC477078 |
0.9748 | High Similarity | NPC329923 |
0.9748 | High Similarity | NPC477075 |
0.9672 | High Similarity | NPC476777 |
0.9672 | High Similarity | NPC476778 |
0.9669 | High Similarity | NPC478153 |
0.9669 | High Similarity | NPC478150 |
0.9669 | High Similarity | NPC478154 |
0.9669 | High Similarity | NPC477195 |
0.9669 | High Similarity | NPC478152 |
0.9593 | High Similarity | NPC279915 |
0.9593 | High Similarity | NPC110700 |
0.959 | High Similarity | NPC476779 |
0.959 | High Similarity | NPC478151 |
0.9587 | High Similarity | NPC173435 |
0.9587 | High Similarity | NPC301639 |
0.9587 | High Similarity | NPC476074 |
0.9587 | High Similarity | NPC45346 |
0.9587 | High Similarity | NPC134914 |
0.9587 | High Similarity | NPC475377 |
0.9587 | High Similarity | NPC264566 |
0.9587 | High Similarity | NPC478065 |
0.9587 | High Similarity | NPC329993 |
0.9587 | High Similarity | NPC478064 |
0.9587 | High Similarity | NPC262796 |
0.9587 | High Similarity | NPC172374 |
0.9587 | High Similarity | NPC475167 |
0.9421 | High Similarity | NPC470475 |
0.9339 | High Similarity | NPC470516 |
0.9333 | High Similarity | NPC471962 |
0.9333 | High Similarity | NPC247315 |
0.9333 | High Similarity | NPC471963 |
0.9328 | High Similarity | NPC213952 |
0.9322 | High Similarity | NPC118440 |
0.9322 | High Similarity | NPC236657 |
0.9262 | High Similarity | NPC470476 |
0.925 | High Similarity | NPC262199 |
0.925 | High Similarity | NPC202666 |
0.925 | High Similarity | NPC257211 |
0.925 | High Similarity | NPC14617 |
0.925 | High Similarity | NPC471961 |
0.925 | High Similarity | NPC471964 |
0.9244 | High Similarity | NPC222580 |
0.9244 | High Similarity | NPC22956 |
0.9244 | High Similarity | NPC104372 |
0.9244 | High Similarity | NPC31838 |
0.9244 | High Similarity | NPC11242 |
0.9244 | High Similarity | NPC223301 |
0.9244 | High Similarity | NPC62725 |
0.9244 | High Similarity | NPC301449 |
0.9244 | High Similarity | NPC302887 |
0.9244 | High Similarity | NPC159309 |
0.9244 | High Similarity | NPC114484 |
0.9244 | High Similarity | NPC86222 |
0.9244 | High Similarity | NPC297263 |
0.9244 | High Similarity | NPC171544 |
0.9244 | High Similarity | NPC64715 |
0.9244 | High Similarity | NPC187618 |
0.9174 | High Similarity | NPC23275 |
0.9174 | High Similarity | NPC33068 |
0.9167 | High Similarity | NPC471965 |
0.9167 | High Similarity | NPC131469 |
0.9167 | High Similarity | NPC80986 |
0.9167 | High Similarity | NPC10607 |
0.9167 | High Similarity | NPC187290 |
0.9167 | High Similarity | NPC162574 |
0.9167 | High Similarity | NPC4749 |
0.9167 | High Similarity | NPC475591 |
0.9167 | High Similarity | NPC313110 |
0.9167 | High Similarity | NPC236870 |
0.9167 | High Similarity | NPC21691 |
0.9098 | High Similarity | NPC284449 |
0.9098 | High Similarity | NPC285091 |
0.9091 | High Similarity | NPC258617 |
0.9091 | High Similarity | NPC478066 |
0.9091 | High Similarity | NPC30735 |
0.9091 | High Similarity | NPC283417 |
0.9091 | High Similarity | NPC200049 |
0.9091 | High Similarity | NPC281148 |
0.9091 | High Similarity | NPC302543 |
0.9091 | High Similarity | NPC2370 |
0.9091 | High Similarity | NPC235405 |
0.9091 | High Similarity | NPC44716 |
0.9076 | High Similarity | NPC469945 |
0.9076 | High Similarity | NPC114441 |
0.9076 | High Similarity | NPC39211 |
0.9076 | High Similarity | NPC35405 |
0.9076 | High Similarity | NPC214484 |
0.9076 | High Similarity | NPC11551 |
0.9076 | High Similarity | NPC309780 |
0.9076 | High Similarity | NPC473884 |
0.9076 | High Similarity | NPC472949 |
0.9076 | High Similarity | NPC157868 |
0.9076 | High Similarity | NPC192791 |
0.9076 | High Similarity | NPC6377 |
0.9076 | High Similarity | NPC208381 |
0.9076 | High Similarity | NPC180550 |
0.9076 | High Similarity | NPC475171 |
0.9068 | High Similarity | NPC224121 |
0.9055 | High Similarity | NPC141215 |
0.9055 | High Similarity | NPC190065 |
0.9055 | High Similarity | NPC471089 |
0.9016 | High Similarity | NPC160452 |
0.9016 | High Similarity | NPC470477 |
0.9008 | High Similarity | NPC40775 |
0.9008 | High Similarity | NPC107966 |
0.9008 | High Similarity | NPC249848 |
0.9008 | High Similarity | NPC235438 |
0.8992 | High Similarity | NPC286347 |
0.8992 | High Similarity | NPC470515 |
0.8992 | High Similarity | NPC471548 |
0.8984 | High Similarity | NPC596 |
0.8984 | High Similarity | NPC295885 |
0.8984 | High Similarity | NPC140045 |
0.8976 | High Similarity | NPC262813 |
0.896 | High Similarity | NPC43589 |
0.896 | High Similarity | NPC300655 |
0.896 | High Similarity | NPC222951 |
0.896 | High Similarity | NPC311178 |
0.8952 | High Similarity | NPC472270 |
0.8952 | High Similarity | NPC23020 |
0.8952 | High Similarity | NPC472269 |
0.8952 | High Similarity | NPC472268 |
0.8952 | High Similarity | NPC112492 |
0.8943 | High Similarity | NPC181066 |
0.8943 | High Similarity | NPC475368 |
0.8943 | High Similarity | NPC469947 |
0.8943 | High Similarity | NPC470218 |
0.8926 | High Similarity | NPC75417 |
0.8926 | High Similarity | NPC242840 |
0.8926 | High Similarity | NPC31193 |
0.8917 | High Similarity | NPC470517 |
0.8917 | High Similarity | NPC473401 |
0.8917 | High Similarity | NPC470915 |
0.8917 | High Similarity | NPC470911 |
0.8908 | High Similarity | NPC300419 |
0.8908 | High Similarity | NPC473405 |
0.8906 | High Similarity | NPC251998 |
0.8889 | High Similarity | NPC319719 |
0.8889 | High Similarity | NPC183816 |
0.8889 | High Similarity | NPC322904 |
0.8889 | High Similarity | NPC473679 |
0.8889 | High Similarity | NPC475444 |
0.8889 | High Similarity | NPC233223 |
0.8889 | High Similarity | NPC324933 |
0.8889 | High Similarity | NPC196874 |
0.8889 | High Similarity | NPC475177 |
0.8843 | High Similarity | NPC294112 |
0.8843 | High Similarity | NPC476127 |
0.8843 | High Similarity | NPC476150 |
0.8833 | High Similarity | NPC109588 |
0.8824 | High Similarity | NPC291903 |
0.8824 | High Similarity | NPC37134 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC97918 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 |
---|---|---|---|
0.925 | High Similarity | NPD8328 | Phase 3 |
0.875 | High Similarity | NPD8295 | Clinical (unspecified phase) |
0.8015 | Intermediate Similarity | NPD7319 | Approved |
0.7953 | Intermediate Similarity | NPD8294 | Approved |
0.7953 | Intermediate Similarity | NPD8377 | Approved |
0.7939 | Intermediate Similarity | NPD7736 | Approved |
0.7934 | Intermediate Similarity | NPD6686 | Approved |
0.7923 | Intermediate Similarity | NPD7507 | Approved |
0.7903 | Intermediate Similarity | NPD8133 | Approved |
0.7891 | Intermediate Similarity | NPD8380 | Approved |
0.7891 | Intermediate Similarity | NPD8513 | Phase 3 |
0.7891 | Intermediate Similarity | NPD8379 | Approved |
0.7891 | Intermediate Similarity | NPD8515 | Approved |
0.7891 | Intermediate Similarity | NPD8378 | Approved |
0.7891 | Intermediate Similarity | NPD8296 | Approved |
0.7891 | Intermediate Similarity | NPD8335 | Approved |
0.7891 | Intermediate Similarity | NPD8517 | Approved |
0.7891 | Intermediate Similarity | NPD8516 | Approved |
0.7869 | Intermediate Similarity | NPD8132 | Clinical (unspecified phase) |
0.7752 | Intermediate Similarity | NPD8033 | Approved |
0.7597 | Intermediate Similarity | NPD7516 | Approved |
0.7594 | Intermediate Similarity | NPD8293 | Discontinued |
0.7557 | Intermediate Similarity | NPD6370 | Approved |
0.7519 | Intermediate Similarity | NPD7327 | Approved |
0.7519 | Intermediate Similarity | NPD7328 | Approved |
0.75 | Intermediate Similarity | NPD5345 | Clinical (unspecified phase) |
0.7481 | Intermediate Similarity | NPD7503 | Approved |
0.7444 | Intermediate Similarity | NPD7492 | Approved |
0.7405 | Intermediate Similarity | NPD6054 | Approved |
0.7405 | Intermediate Similarity | NPD6319 | Approved |
0.7388 | Intermediate Similarity | NPD6616 | Approved |
0.7333 | Intermediate Similarity | NPD7078 | Approved |
0.728 | Intermediate Similarity | NPD6412 | Phase 2 |
0.7273 | Intermediate Similarity | NPD6059 | Approved |
0.7266 | Intermediate Similarity | NPD8297 | Approved |
0.7266 | Intermediate Similarity | NPD6882 | Approved |
0.7218 | Intermediate Similarity | NPD6015 | Approved |
0.7218 | Intermediate Similarity | NPD6016 | Approved |
0.719 | Intermediate Similarity | NPD7902 | Approved |
0.7188 | Intermediate Similarity | NPD8413 | Clinical (unspecified phase) |
0.7176 | Intermediate Similarity | NPD7115 | Discovery |
0.7176 | Intermediate Similarity | NPD6009 | Approved |
0.7164 | Intermediate Similarity | NPD5988 | Approved |
0.7131 | Intermediate Similarity | NPD7638 | Approved |
0.7131 | Intermediate Similarity | NPD4225 | Approved |
0.7083 | Intermediate Similarity | NPD7748 | Approved |
0.7073 | Intermediate Similarity | NPD7639 | Approved |
0.7073 | Intermediate Similarity | NPD7640 | Approved |
0.7054 | Intermediate Similarity | NPD6649 | Approved |
0.7054 | Intermediate Similarity | NPD6650 | Approved |
0.7031 | Intermediate Similarity | NPD6373 | Approved |
0.7031 | Intermediate Similarity | NPD4061 | Clinical (unspecified phase) |
0.7031 | Intermediate Similarity | NPD6372 | Approved |
0.6977 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.6963 | Remote Similarity | NPD6921 | Approved |
0.6957 | Remote Similarity | NPD8074 | Phase 3 |
0.6953 | Remote Similarity | NPD6881 | Approved |
0.6953 | Remote Similarity | NPD6899 | Approved |
0.6947 | Remote Similarity | NPD4632 | Approved |
0.6942 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.6942 | Remote Similarity | NPD7900 | Approved |
0.6929 | Remote Similarity | NPD5739 | Approved |
0.6929 | Remote Similarity | NPD6402 | Approved |
0.6929 | Remote Similarity | NPD7128 | Approved |
0.6929 | Remote Similarity | NPD6675 | Approved |
0.6923 | Remote Similarity | NPD8130 | Phase 1 |
0.6917 | Remote Similarity | NPD7515 | Phase 2 |
0.6875 | Remote Similarity | NPD5697 | Approved |
0.6846 | Remote Similarity | NPD7290 | Approved |
0.6846 | Remote Similarity | NPD7102 | Approved |
0.6846 | Remote Similarity | NPD6883 | Approved |
0.6822 | Remote Similarity | NPD7320 | Approved |
0.6794 | Remote Similarity | NPD6617 | Approved |
0.6794 | Remote Similarity | NPD6869 | Approved |
0.6794 | Remote Similarity | NPD6847 | Approved |
0.6786 | Remote Similarity | NPD6033 | Approved |
0.6769 | Remote Similarity | NPD6014 | Approved |
0.6769 | Remote Similarity | NPD6012 | Approved |
0.6769 | Remote Similarity | NPD6013 | Approved |
0.6744 | Remote Similarity | NPD5701 | Approved |
0.6744 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.6739 | Remote Similarity | NPD7604 | Phase 2 |
0.672 | Remote Similarity | NPD8029 | Clinical (unspecified phase) |
0.6719 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.6718 | Remote Similarity | NPD4634 | Approved |
0.6715 | Remote Similarity | NPD5983 | Phase 2 |
0.6692 | Remote Similarity | NPD6011 | Approved |
0.6644 | Remote Similarity | NPD7966 | Clinical (unspecified phase) |
0.6643 | Remote Similarity | NPD6336 | Discontinued |
0.6619 | Remote Similarity | NPD7830 | Approved |
0.6619 | Remote Similarity | NPD7829 | Approved |
0.6615 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6575 | Remote Similarity | NPD8387 | Clinical (unspecified phase) |
0.6566 | Remote Similarity | NPD7799 | Discontinued |
0.6562 | Remote Similarity | NPD7632 | Discontinued |
0.6557 | Remote Similarity | NPD6698 | Approved |
0.6557 | Remote Similarity | NPD46 | Approved |
0.6541 | Remote Similarity | NPD6401 | Clinical (unspecified phase) |
0.6528 | Remote Similarity | NPD7260 | Phase 2 |
0.6507 | Remote Similarity | NPD8415 | Approved |
0.6484 | Remote Similarity | NPD5344 | Discontinued |
0.6479 | Remote Similarity | NPD8448 | Approved |
0.6471 | Remote Similarity | NPD6274 | Approved |
0.6471 | Remote Similarity | NPD7625 | Phase 1 |
0.6458 | Remote Similarity | NPD8392 | Approved |
0.6458 | Remote Similarity | NPD8391 | Approved |
0.6458 | Remote Similarity | NPD8390 | Approved |
0.6449 | Remote Similarity | NPD7101 | Approved |
0.6449 | Remote Similarity | NPD7100 | Approved |
0.6434 | Remote Similarity | NPD5211 | Phase 2 |
0.6412 | Remote Similarity | NPD8368 | Discontinued |
0.6408 | Remote Similarity | NPD8451 | Approved |
0.6406 | Remote Similarity | NPD4696 | Approved |
0.6406 | Remote Similarity | NPD5286 | Approved |
0.6406 | Remote Similarity | NPD5285 | Approved |
0.6383 | Remote Similarity | NPD6067 | Discontinued |
0.6378 | Remote Similarity | NPD4755 | Approved |
0.6378 | Remote Similarity | NPD6083 | Phase 2 |
0.6378 | Remote Similarity | NPD6084 | Phase 2 |
0.6377 | Remote Similarity | NPD6335 | Approved |
0.6371 | Remote Similarity | NPD8034 | Phase 2 |
0.6371 | Remote Similarity | NPD6411 | Approved |
0.6371 | Remote Similarity | NPD7983 | Approved |
0.6371 | Remote Similarity | NPD8035 | Phase 2 |
0.635 | Remote Similarity | NPD6868 | Approved |
0.6343 | Remote Similarity | NPD6371 | Approved |
0.6336 | Remote Similarity | NPD5141 | Approved |
0.632 | Remote Similarity | NPD5778 | Approved |
0.632 | Remote Similarity | NPD5779 | Approved |
0.6312 | Remote Similarity | NPD8080 | Discontinued |
0.6311 | Remote Similarity | NPD3573 | Approved |
0.6308 | Remote Similarity | NPD5225 | Approved |
0.6308 | Remote Similarity | NPD4633 | Approved |
0.6308 | Remote Similarity | NPD5226 | Approved |
0.6308 | Remote Similarity | NPD5224 | Approved |
0.6304 | Remote Similarity | NPD6317 | Approved |
0.6301 | Remote Similarity | NPD8407 | Phase 2 |
0.6299 | Remote Similarity | NPD4697 | Phase 3 |
0.6299 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.6299 | Remote Similarity | NPD5222 | Approved |
0.6299 | Remote Similarity | NPD5221 | Approved |
0.629 | Remote Similarity | NPD7838 | Discovery |
0.6288 | Remote Similarity | NPD6008 | Approved |
0.6279 | Remote Similarity | NPD4700 | Approved |
0.6268 | Remote Similarity | NPD7642 | Approved |
0.626 | Remote Similarity | NPD5174 | Approved |
0.626 | Remote Similarity | NPD5175 | Approved |
0.6259 | Remote Similarity | NPD6845 | Suspended |
0.6259 | Remote Similarity | NPD6314 | Approved |
0.6259 | Remote Similarity | NPD6313 | Approved |
0.625 | Remote Similarity | NPD5173 | Approved |
0.625 | Remote Similarity | NPD6053 | Discontinued |
0.6241 | Remote Similarity | NPD6908 | Approved |
0.6241 | Remote Similarity | NPD6909 | Approved |
0.6241 | Remote Similarity | NPD8444 | Approved |
0.624 | Remote Similarity | NPD6079 | Approved |
0.6235 | Remote Similarity | NPD8470 | Clinical (unspecified phase) |
0.6233 | Remote Similarity | NPD5956 | Approved |
0.6231 | Remote Similarity | NPD5223 | Approved |
0.6224 | Remote Similarity | NPD8342 | Approved |
0.6224 | Remote Similarity | NPD8299 | Approved |
0.6224 | Remote Similarity | NPD8341 | Approved |
0.6224 | Remote Similarity | NPD8340 | Approved |
0.621 | Remote Similarity | NPD5328 | Approved |
0.621 | Remote Similarity | NPD6101 | Approved |
0.621 | Remote Similarity | NPD5764 | Clinical (unspecified phase) |
0.6207 | Remote Similarity | NPD8337 | Approved |
0.6207 | Remote Similarity | NPD8336 | Approved |
0.6202 | Remote Similarity | NPD5696 | Approved |
0.6194 | Remote Similarity | NPD4730 | Approved |
0.6194 | Remote Similarity | NPD4729 | Approved |
0.619 | Remote Similarity | NPD8171 | Discontinued |
0.619 | Remote Similarity | NPD6399 | Phase 3 |
0.6186 | Remote Similarity | NPD7645 | Phase 2 |
0.618 | Remote Similarity | NPD7879 | Clinical (unspecified phase) |
0.6165 | Remote Similarity | NPD4768 | Approved |
0.6165 | Remote Similarity | NPD4767 | Approved |
0.6158 | Remote Similarity | NPD8435 | Approved |
0.6154 | Remote Similarity | NPD6648 | Approved |
0.6149 | Remote Similarity | NPD8338 | Approved |
0.6129 | Remote Similarity | NPD5737 | Approved |
0.6129 | Remote Similarity | NPD6672 | Approved |
0.6127 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.6127 | Remote Similarity | NPD6291 | Clinical (unspecified phase) |
0.612 | Remote Similarity | NPD8486 | Clinical (unspecified phase) |
0.6103 | Remote Similarity | NPD5247 | Approved |
0.6103 | Remote Similarity | NPD5248 | Approved |
0.6103 | Remote Similarity | NPD5249 | Phase 3 |
0.6103 | Remote Similarity | NPD5250 | Approved |
0.6103 | Remote Similarity | NPD5251 | Approved |
0.6098 | Remote Similarity | NPD3618 | Phase 1 |
0.6094 | Remote Similarity | NPD5695 | Phase 3 |
0.6094 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.608 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.6075 | Remote Similarity | NPD8320 | Phase 1 |
0.6075 | Remote Similarity | NPD8319 | Approved |
0.6074 | Remote Similarity | NPD5128 | Approved |
0.6067 | Remote Similarity | NPD8361 | Approved |
0.6067 | Remote Similarity | NPD8360 | Approved |
0.6057 | Remote Similarity | NPD8312 | Approved |
PubChem CID   | 6476035 |
ChEMBL   | CHEMBL448282 |
ZINC   |
Molecular Weight:   | 1130.55 |
ALogP:   | -3.9256 |
MLogP:   | 4.87 |
XLogP:   | 1.683 |
# Rotatable Bonds:   | 38 |
Polar Surface Area:   | 388.04 |
# H-Bond Aceptor:   | 24 |
# H-Bond Donor:   | 13 |
# Rings:   | 8 |
# Heavy Atoms:   | 79 |