Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT116 | Cell Line | HL-60 | Homo sapiens | IC50 | > | 100 | ug/ml | 15165134 |
NPT181 | Cell Line | Bel-7402 | Homo sapiens | IC50 | > | 100 | ug/ml | 15165134 |
NPT165 | Cell Line | HeLa | Homo sapiens | IC50 | > | 100 | ug/ml | 15165134 |
NPT466 | Cell Line | U-937 | Homo sapiens | IC50 | > | 100 | ug/ml | 15165134 |
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 NPC34622 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 | NPC474400 |
0.9833 | High Similarity | NPC98897 |
0.9831 | High Similarity | NPC57463 |
0.9831 | High Similarity | NPC151728 |
0.9672 | High Similarity | NPC16119 |
0.9516 | High Similarity | NPC474619 |
0.9322 | High Similarity | NPC473494 |
0.9219 | High Similarity | NPC262673 |
0.9206 | High Similarity | NPC243272 |
0.9077 | High Similarity | NPC291062 |
0.9077 | High Similarity | NPC94743 |
0.9062 | High Similarity | NPC263382 |
0.9062 | High Similarity | NPC134385 |
0.9062 | High Similarity | NPC146376 |
0.9062 | High Similarity | NPC125578 |
0.8923 | High Similarity | NPC94488 |
0.8871 | High Similarity | NPC477830 |
0.8676 | High Similarity | NPC264178 |
0.8571 | High Similarity | NPC143168 |
0.8571 | High Similarity | NPC53109 |
0.8438 | Intermediate Similarity | NPC7029 |
0.8305 | Intermediate Similarity | NPC474805 |
0.8226 | Intermediate Similarity | NPC139056 |
0.8167 | Intermediate Similarity | NPC317796 |
0.8065 | Intermediate Similarity | NPC224103 |
0.8065 | Intermediate Similarity | NPC200831 |
0.8065 | Intermediate Similarity | NPC299369 |
0.8056 | Intermediate Similarity | NPC473536 |
0.7937 | Intermediate Similarity | NPC320421 |
0.7867 | Intermediate Similarity | NPC474085 |
0.7808 | Intermediate Similarity | NPC283087 |
0.7797 | Intermediate Similarity | NPC220191 |
0.7727 | Intermediate Similarity | NPC477707 |
0.7667 | Intermediate Similarity | NPC22329 |
0.7606 | Intermediate Similarity | NPC474539 |
0.7468 | Intermediate Similarity | NPC132228 |
0.7468 | Intermediate Similarity | NPC8518 |
0.7468 | Intermediate Similarity | NPC133652 |
0.7468 | Intermediate Similarity | NPC6185 |
0.7468 | Intermediate Similarity | NPC263997 |
0.7468 | Intermediate Similarity | NPC241512 |
0.7432 | Intermediate Similarity | NPC477708 |
0.7424 | Intermediate Similarity | NPC143857 |
0.7424 | Intermediate Similarity | NPC229252 |
0.7397 | Intermediate Similarity | NPC147438 |
0.7286 | Intermediate Similarity | NPC251429 |
0.7286 | Intermediate Similarity | NPC298249 |
0.7237 | Intermediate Similarity | NPC23778 |
0.72 | Intermediate Similarity | NPC26504 |
0.7179 | Intermediate Similarity | NPC474353 |
0.7119 | Intermediate Similarity | NPC191337 |
0.7083 | Intermediate Similarity | NPC469914 |
0.7051 | Intermediate Similarity | NPC108955 |
0.7051 | Intermediate Similarity | NPC304795 |
0.7049 | Intermediate Similarity | NPC145311 |
0.7031 | Intermediate Similarity | NPC129710 |
0.7024 | Intermediate Similarity | NPC223093 |
0.7015 | Intermediate Similarity | NPC274927 |
0.7015 | Intermediate Similarity | NPC106851 |
0.7013 | Intermediate Similarity | NPC478246 |
0.7013 | Intermediate Similarity | NPC231739 |
0.7013 | Intermediate Similarity | NPC478247 |
0.6986 | Remote Similarity | NPC477455 |
0.6984 | Remote Similarity | NPC137396 |
0.6974 | Remote Similarity | NPC110725 |
0.6974 | Remote Similarity | NPC40353 |
0.697 | Remote Similarity | NPC281230 |
0.697 | Remote Similarity | NPC192843 |
0.6962 | Remote Similarity | NPC286229 |
0.6962 | Remote Similarity | NPC55869 |
0.6962 | Remote Similarity | NPC99308 |
0.6951 | Remote Similarity | NPC203795 |
0.6951 | Remote Similarity | NPC472009 |
0.6949 | Remote Similarity | NPC25771 |
0.6949 | Remote Similarity | NPC477686 |
0.6944 | Remote Similarity | NPC134593 |
0.6944 | Remote Similarity | NPC218477 |
0.6941 | Remote Similarity | NPC32944 |
0.6941 | Remote Similarity | NPC193396 |
0.6935 | Remote Similarity | NPC15325 |
0.6923 | Remote Similarity | NPC476177 |
0.6923 | Remote Similarity | NPC471740 |
0.6912 | Remote Similarity | NPC235242 |
0.6912 | Remote Similarity | NPC122521 |
0.6912 | Remote Similarity | NPC174447 |
0.6912 | Remote Similarity | NPC251042 |
0.6905 | Remote Similarity | NPC142159 |
0.6905 | Remote Similarity | NPC95364 |
0.6883 | Remote Similarity | NPC180290 |
0.6883 | Remote Similarity | NPC471061 |
0.6875 | Remote Similarity | NPC39633 |
0.6875 | Remote Similarity | NPC103486 |
0.6875 | Remote Similarity | NPC309606 |
0.6875 | Remote Similarity | NPC139545 |
0.6875 | Remote Similarity | NPC47450 |
0.6875 | Remote Similarity | NPC168521 |
0.6867 | Remote Similarity | NPC472007 |
0.6849 | Remote Similarity | NPC477449 |
0.6849 | Remote Similarity | NPC474060 |
0.6849 | Remote Similarity | NPC477448 |
0.6829 | Remote Similarity | NPC77971 |
0.6829 | Remote Similarity | NPC470177 |
0.6829 | Remote Similarity | NPC32037 |
0.6829 | Remote Similarity | NPC474680 |
0.6825 | Remote Similarity | NPC477458 |
0.6825 | Remote Similarity | NPC234829 |
0.6824 | Remote Similarity | NPC475823 |
0.6824 | Remote Similarity | NPC474209 |
0.6812 | Remote Similarity | NPC40082 |
0.6795 | Remote Similarity | NPC475994 |
0.679 | Remote Similarity | NPC8091 |
0.679 | Remote Similarity | NPC288281 |
0.6786 | Remote Similarity | NPC472008 |
0.6786 | Remote Similarity | NPC53454 |
0.678 | Remote Similarity | NPC292463 |
0.6757 | Remote Similarity | NPC173321 |
0.6753 | Remote Similarity | NPC473223 |
0.6753 | Remote Similarity | NPC470525 |
0.675 | Remote Similarity | NPC475833 |
0.675 | Remote Similarity | NPC149237 |
0.675 | Remote Similarity | NPC225515 |
0.675 | Remote Similarity | NPC478262 |
0.6744 | Remote Similarity | NPC166110 |
0.6712 | Remote Similarity | NPC477452 |
0.6709 | Remote Similarity | NPC475681 |
0.6709 | Remote Similarity | NPC27817 |
0.6707 | Remote Similarity | NPC474359 |
0.6706 | Remote Similarity | NPC280833 |
0.6667 | Remote Similarity | NPC10316 |
0.6667 | Remote Similarity | NPC200845 |
0.6667 | Remote Similarity | NPC472300 |
0.6667 | Remote Similarity | NPC221231 |
0.6667 | Remote Similarity | NPC28779 |
0.6667 | Remote Similarity | NPC474391 |
0.6667 | Remote Similarity | NPC224227 |
0.6667 | Remote Similarity | NPC211279 |
0.6667 | Remote Similarity | NPC128061 |
0.6667 | Remote Similarity | NPC106547 |
0.6667 | Remote Similarity | NPC471225 |
0.6667 | Remote Similarity | NPC228473 |
0.6667 | Remote Similarity | NPC223677 |
0.6667 | Remote Similarity | NPC248193 |
0.6667 | Remote Similarity | NPC66365 |
0.6667 | Remote Similarity | NPC471739 |
0.6667 | Remote Similarity | NPC186531 |
0.6667 | Remote Similarity | NPC84038 |
0.6667 | Remote Similarity | NPC41780 |
0.6667 | Remote Similarity | NPC197089 |
0.6667 | Remote Similarity | NPC187568 |
0.6667 | Remote Similarity | NPC32351 |
0.6667 | Remote Similarity | NPC471326 |
0.6628 | Remote Similarity | NPC471399 |
0.6627 | Remote Similarity | NPC96621 |
0.6627 | Remote Similarity | NPC90287 |
0.6625 | Remote Similarity | NPC162741 |
0.6625 | Remote Similarity | NPC91332 |
0.6623 | Remote Similarity | NPC329826 |
0.6623 | Remote Similarity | NPC469414 |
0.6623 | Remote Similarity | NPC244166 |
0.6623 | Remote Similarity | NPC175079 |
0.6622 | Remote Similarity | NPC261398 |
0.6622 | Remote Similarity | NPC250928 |
0.6622 | Remote Similarity | NPC10758 |
0.662 | Remote Similarity | NPC477457 |
0.662 | Remote Similarity | NPC477456 |
0.662 | Remote Similarity | NPC150162 |
0.6615 | Remote Similarity | NPC71761 |
0.6588 | Remote Similarity | NPC241507 |
0.6585 | Remote Similarity | NPC474703 |
0.6585 | Remote Similarity | NPC477785 |
0.6585 | Remote Similarity | NPC477786 |
0.6585 | Remote Similarity | NPC477784 |
0.6585 | Remote Similarity | NPC105803 |
0.6582 | Remote Similarity | NPC478122 |
0.6582 | Remote Similarity | NPC469996 |
0.6582 | Remote Similarity | NPC471220 |
0.6582 | Remote Similarity | NPC189485 |
0.6579 | Remote Similarity | NPC474705 |
0.6575 | Remote Similarity | NPC203335 |
0.6575 | Remote Similarity | NPC473213 |
0.6571 | Remote Similarity | NPC201939 |
0.6567 | Remote Similarity | NPC473733 |
0.6567 | Remote Similarity | NPC477201 |
0.6562 | Remote Similarity | NPC262968 |
0.6557 | Remote Similarity | NPC110396 |
0.6552 | Remote Similarity | NPC146852 |
0.6552 | Remote Similarity | NPC476484 |
0.6548 | Remote Similarity | NPC472161 |
0.6548 | Remote Similarity | NPC472136 |
0.6543 | Remote Similarity | NPC275766 |
0.6538 | Remote Similarity | NPC92080 |
0.6538 | Remote Similarity | NPC1254 |
0.6538 | Remote Similarity | NPC474527 |
0.6538 | Remote Similarity | NPC27205 |
0.6538 | Remote Similarity | NPC266119 |
0.6538 | Remote Similarity | NPC471726 |
0.6528 | Remote Similarity | NPC61473 |
0.6528 | Remote Similarity | NPC474304 |
0.6528 | Remote Similarity | NPC251118 |
0.6528 | Remote Similarity | NPC474329 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC34622 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 |
---|---|---|---|
0.9672 | High Similarity | NPD6108 | Clinical (unspecified phase) |
0.8571 | High Similarity | NPD2664 | Clinical (unspecified phase) |
0.8462 | Intermediate Similarity | NPD3704 | Approved |
0.831 | Intermediate Similarity | NPD4756 | Discovery |
0.8065 | Intermediate Similarity | NPD8779 | Phase 3 |
0.7143 | Intermediate Similarity | NPD7331 | Phase 2 |
0.7051 | Intermediate Similarity | NPD4695 | Discontinued |
0.6667 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.6562 | Remote Similarity | NPD29 | Approved |
0.6562 | Remote Similarity | NPD28 | Approved |
0.6528 | Remote Similarity | NPD7341 | Phase 2 |
0.6395 | Remote Similarity | NPD5737 | Approved |
0.6395 | Remote Similarity | NPD6672 | Approved |
0.6389 | Remote Similarity | NPD3197 | Phase 1 |
0.6364 | Remote Similarity | NPD3172 | Approved |
0.6269 | Remote Similarity | NPD3195 | Phase 2 |
0.6269 | Remote Similarity | NPD3194 | Approved |
0.6269 | Remote Similarity | NPD3196 | Approved |
0.6269 | Remote Similarity | NPD4266 | Approved |
0.6222 | Remote Similarity | NPD5282 | Discontinued |
0.622 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.619 | Remote Similarity | NPD6110 | Phase 1 |
0.6173 | Remote Similarity | NPD3617 | Approved |
0.6163 | Remote Similarity | NPD5279 | Phase 3 |
0.6163 | Remote Similarity | NPD5690 | Phase 2 |
0.6136 | Remote Similarity | NPD6904 | Approved |
0.6136 | Remote Similarity | NPD6673 | Approved |
0.6136 | Remote Similarity | NPD6080 | Approved |
0.6118 | Remote Similarity | NPD4197 | Approved |
0.6104 | Remote Similarity | NPD4691 | Approved |
0.6067 | Remote Similarity | NPD5692 | Phase 3 |
0.6047 | Remote Similarity | NPD5329 | Approved |
0.6032 | Remote Similarity | NPD3174 | Discontinued |
0.6 | Remote Similarity | NPD5694 | Approved |
0.6 | Remote Similarity | NPD6050 | Approved |
0.6 | Remote Similarity | NPD5693 | Phase 1 |
0.6 | Remote Similarity | NPD8039 | Approved |
0.5978 | Remote Similarity | NPD5695 | Phase 3 |
0.5977 | Remote Similarity | NPD4694 | Approved |
0.5977 | Remote Similarity | NPD5330 | Approved |
0.5977 | Remote Similarity | NPD6098 | Approved |
0.5977 | Remote Similarity | NPD7334 | Approved |
0.5977 | Remote Similarity | NPD7146 | Approved |
0.5977 | Remote Similarity | NPD5280 | Approved |
0.5977 | Remote Similarity | NPD7521 | Approved |
0.5977 | Remote Similarity | NPD6409 | Approved |
0.5977 | Remote Similarity | NPD6684 | Approved |
0.5974 | Remote Similarity | NPD4137 | Phase 3 |
0.5955 | Remote Similarity | NPD4753 | Phase 2 |
0.5955 | Remote Similarity | NPD7285 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD3665 | Phase 1 |
0.593 | Remote Similarity | NPD3133 | Approved |
0.593 | Remote Similarity | NPD3666 | Approved |
0.5909 | Remote Similarity | NPD3573 | Approved |
0.5897 | Remote Similarity | NPD4747 | Approved |
0.5882 | Remote Similarity | NPD4221 | Approved |
0.5882 | Remote Similarity | NPD3667 | Approved |
0.5882 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD4223 | Phase 3 |
0.5875 | Remote Similarity | NPD4058 | Approved |
0.5862 | Remote Similarity | NPD1696 | Phase 3 |
0.5862 | Remote Similarity | NPD1694 | Approved |
0.5851 | Remote Similarity | NPD6084 | Phase 2 |
0.5851 | Remote Similarity | NPD6083 | Phase 2 |
0.5843 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5843 | Remote Similarity | NPD6903 | Approved |
0.5833 | Remote Similarity | NPD5783 | Phase 3 |
0.5823 | Remote Similarity | NPD5276 | Approved |
0.5814 | Remote Similarity | NPD7154 | Phase 3 |
0.5806 | Remote Similarity | NPD9297 | Discontinued |
0.5806 | Remote Similarity | NPD5210 | Approved |
0.5806 | Remote Similarity | NPD9091 | Suspended |
0.5806 | Remote Similarity | NPD4629 | Approved |
0.5795 | Remote Similarity | NPD3618 | Phase 1 |
0.5789 | Remote Similarity | NPD5696 | Approved |
0.5758 | Remote Similarity | NPD3173 | Approved |
0.5747 | Remote Similarity | NPD3668 | Phase 3 |
0.5747 | Remote Similarity | NPD4786 | Approved |
0.5745 | Remote Similarity | NPD5222 | Approved |
0.5745 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5745 | Remote Similarity | NPD5221 | Approved |
0.5694 | Remote Similarity | NPD287 | Approved |
0.5684 | Remote Similarity | NPD5173 | Approved |
0.5682 | Remote Similarity | NPD5363 | Approved |
0.5679 | Remote Similarity | NPD5733 | Approved |
0.5679 | Remote Similarity | NPD4687 | Approved |
0.5667 | Remote Similarity | NPD5208 | Approved |
0.5667 | Remote Similarity | NPD4518 | Approved |
0.5658 | Remote Similarity | NPD2685 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD6079 | Approved |
0.5638 | Remote Similarity | NPD5654 | Approved |
0.5618 | Remote Similarity | NPD4519 | Discontinued |
0.5618 | Remote Similarity | NPD4693 | Phase 3 |
0.5618 | Remote Similarity | NPD4623 | Approved |
0.5618 | Remote Similarity | NPD4690 | Approved |
0.5618 | Remote Similarity | NPD5205 | Approved |
0.5618 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.5618 | Remote Similarity | NPD4689 | Approved |
0.5618 | Remote Similarity | NPD4138 | Approved |
0.5618 | Remote Similarity | NPD4688 | Approved |
0.5606 | Remote Similarity | NPD622 | Approved |
0.5606 | Remote Similarity | NPD5343 | Approved |
0.5604 | Remote Similarity | NPD5328 | Approved |
PubChem CID   | 44559530 |
ChEMBL   | CHEMBL469433 |
ZINC   |
Molecular Weight:   | 292.20 |
ALogP:   | -2.9779 |
MLogP:   | 3.11 |
XLogP:   | 5.778 |
# Rotatable Bonds:   | 13 |
Polar Surface Area:   | 43.37 |
# H-Bond Aceptor:   | 3 |
# H-Bond Donor:   | 0 |
# Rings:   | 1 |
# Heavy Atoms:   | 21 |