Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | > | 40000 | nM | 25590529 |
NPT83 | Cell Line | MCF7 | Homo sapiens | IC50 | > | 40000 | nM | 25590529 |
NPT659 | Cell Line | SMMC-7721 | Homo sapiens | IC50 | > | 40000 | nM | 25590529 |
NPT660 | Cell Line | SW480 | Homo sapiens | IC50 | > | 40000 | nM | 25590529 |
NPT2 | Others | Unspecified | IC50 | > | 40000 | nM | 25590529 |
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 NPC477352 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 |
---|---|---|
0.7563 | Intermediate Similarity | NPC127408 |
0.7563 | Intermediate Similarity | NPC291785 |
0.7373 | Intermediate Similarity | NPC231060 |
0.7373 | Intermediate Similarity | NPC84018 |
0.7373 | Intermediate Similarity | NPC41070 |
0.7373 | Intermediate Similarity | NPC138245 |
0.735 | Intermediate Similarity | NPC181594 |
0.735 | Intermediate Similarity | NPC144739 |
0.7288 | Intermediate Similarity | NPC215271 |
0.7288 | Intermediate Similarity | NPC261333 |
0.7288 | Intermediate Similarity | NPC289539 |
0.7288 | Intermediate Similarity | NPC104371 |
0.7288 | Intermediate Similarity | NPC101233 |
0.7288 | Intermediate Similarity | NPC191094 |
0.7288 | Intermediate Similarity | NPC29247 |
0.7288 | Intermediate Similarity | NPC129004 |
0.7288 | Intermediate Similarity | NPC302008 |
0.7288 | Intermediate Similarity | NPC292374 |
0.7288 | Intermediate Similarity | NPC91772 |
0.7288 | Intermediate Similarity | NPC153775 |
0.7288 | Intermediate Similarity | NPC111524 |
0.728 | Intermediate Similarity | NPC55973 |
0.7265 | Intermediate Similarity | NPC476168 |
0.7265 | Intermediate Similarity | NPC299185 |
0.7203 | Intermediate Similarity | NPC59170 |
0.72 | Intermediate Similarity | NPC67745 |
0.72 | Intermediate Similarity | NPC471461 |
0.7179 | Intermediate Similarity | NPC149761 |
0.7179 | Intermediate Similarity | NPC180849 |
0.7179 | Intermediate Similarity | NPC80401 |
0.7179 | Intermediate Similarity | NPC470378 |
0.7179 | Intermediate Similarity | NPC261994 |
0.7167 | Intermediate Similarity | NPC135548 |
0.7167 | Intermediate Similarity | NPC140242 |
0.7167 | Intermediate Similarity | NPC264979 |
0.7165 | Intermediate Similarity | NPC471093 |
0.7165 | Intermediate Similarity | NPC473324 |
0.7143 | Intermediate Similarity | NPC231278 |
0.7143 | Intermediate Similarity | NPC112895 |
0.7143 | Intermediate Similarity | NPC189663 |
0.7143 | Intermediate Similarity | NPC89860 |
0.7143 | Intermediate Similarity | NPC218123 |
0.7132 | Intermediate Similarity | NPC106479 |
0.7131 | Intermediate Similarity | NPC470388 |
0.7109 | Intermediate Similarity | NPC122339 |
0.7109 | Intermediate Similarity | NPC29505 |
0.7107 | Intermediate Similarity | NPC170978 |
0.7087 | Intermediate Similarity | NPC252679 |
0.7087 | Intermediate Similarity | NPC118721 |
0.7083 | Intermediate Similarity | NPC142352 |
0.7083 | Intermediate Similarity | NPC29112 |
0.7059 | Intermediate Similarity | NPC59350 |
0.7054 | Intermediate Similarity | NPC473303 |
0.7054 | Intermediate Similarity | NPC471245 |
0.7031 | Intermediate Similarity | NPC471476 |
0.7016 | Intermediate Similarity | NPC309388 |
0.7016 | Intermediate Similarity | NPC475803 |
0.7008 | Intermediate Similarity | NPC273155 |
0.7008 | Intermediate Similarity | NPC63841 |
0.7 | Intermediate Similarity | NPC471252 |
0.7 | Intermediate Similarity | NPC64006 |
0.7 | Intermediate Similarity | NPC471248 |
0.6992 | Remote Similarity | NPC156324 |
0.6992 | Remote Similarity | NPC55503 |
0.6984 | Remote Similarity | NPC130511 |
0.6984 | Remote Similarity | NPC307660 |
0.6977 | Remote Similarity | NPC213320 |
0.6977 | Remote Similarity | NPC63244 |
0.6975 | Remote Similarity | NPC278106 |
0.696 | Remote Similarity | NPC277074 |
0.696 | Remote Similarity | NPC87927 |
0.696 | Remote Similarity | NPC209298 |
0.6953 | Remote Similarity | NPC102741 |
0.6935 | Remote Similarity | NPC471790 |
0.6935 | Remote Similarity | NPC163963 |
0.6935 | Remote Similarity | NPC289148 |
0.6935 | Remote Similarity | NPC52899 |
0.6929 | Remote Similarity | NPC166993 |
0.6929 | Remote Similarity | NPC186054 |
0.6923 | Remote Similarity | NPC165895 |
0.6923 | Remote Similarity | NPC471244 |
0.6923 | Remote Similarity | NPC474927 |
0.6923 | Remote Similarity | NPC153604 |
0.6923 | Remote Similarity | NPC473397 |
0.6923 | Remote Similarity | NPC145625 |
0.6923 | Remote Similarity | NPC259009 |
0.6923 | Remote Similarity | NPC174619 |
0.6923 | Remote Similarity | NPC473352 |
0.6917 | Remote Similarity | NPC472496 |
0.6905 | Remote Similarity | NPC13149 |
0.6885 | Remote Similarity | NPC13949 |
0.688 | Remote Similarity | NPC214946 |
0.688 | Remote Similarity | NPC76866 |
0.688 | Remote Similarity | NPC88203 |
0.688 | Remote Similarity | NPC304832 |
0.688 | Remote Similarity | NPC272472 |
0.688 | Remote Similarity | NPC148628 |
0.688 | Remote Similarity | NPC246736 |
0.688 | Remote Similarity | NPC286519 |
0.6875 | Remote Similarity | NPC469984 |
0.6875 | Remote Similarity | NPC471094 |
0.6875 | Remote Similarity | NPC469733 |
0.6875 | Remote Similarity | NPC469729 |
0.6875 | Remote Similarity | NPC473410 |
0.687 | Remote Similarity | NPC132668 |
0.687 | Remote Similarity | NPC94141 |
0.686 | Remote Similarity | NPC280804 |
0.6855 | Remote Similarity | NPC287676 |
0.685 | Remote Similarity | NPC4115 |
0.685 | Remote Similarity | NPC12823 |
0.685 | Remote Similarity | NPC200957 |
0.685 | Remote Similarity | NPC138908 |
0.6846 | Remote Similarity | NPC471243 |
0.6842 | Remote Similarity | NPC473304 |
0.6833 | Remote Similarity | NPC198242 |
0.6833 | Remote Similarity | NPC211403 |
0.6825 | Remote Similarity | NPC216114 |
0.6825 | Remote Similarity | NPC122811 |
0.6825 | Remote Similarity | NPC139347 |
0.6818 | Remote Similarity | NPC17165 |
0.6818 | Remote Similarity | NPC243354 |
0.6809 | Remote Similarity | NPC139585 |
0.68 | Remote Similarity | NPC46848 |
0.68 | Remote Similarity | NPC60947 |
0.68 | Remote Similarity | NPC14634 |
0.6797 | Remote Similarity | NPC475800 |
0.6797 | Remote Similarity | NPC469746 |
0.6797 | Remote Similarity | NPC471474 |
0.6794 | Remote Similarity | NPC157929 |
0.6777 | Remote Similarity | NPC82138 |
0.6774 | Remote Similarity | NPC78427 |
0.6774 | Remote Similarity | NPC471038 |
0.6774 | Remote Similarity | NPC16911 |
0.6772 | Remote Similarity | NPC98603 |
0.6772 | Remote Similarity | NPC202793 |
0.6772 | Remote Similarity | NPC84928 |
0.6772 | Remote Similarity | NPC474558 |
0.6772 | Remote Similarity | NPC301787 |
0.6769 | Remote Similarity | NPC85391 |
0.6769 | Remote Similarity | NPC320383 |
0.6769 | Remote Similarity | NPC474786 |
0.6769 | Remote Similarity | NPC137104 |
0.6767 | Remote Similarity | NPC88945 |
0.6767 | Remote Similarity | NPC229752 |
0.6752 | Remote Similarity | NPC102292 |
0.6752 | Remote Similarity | NPC471034 |
0.6752 | Remote Similarity | NPC190704 |
0.675 | Remote Similarity | NPC100313 |
0.6748 | Remote Similarity | NPC104568 |
0.6746 | Remote Similarity | NPC275990 |
0.6744 | Remote Similarity | NPC9013 |
0.6721 | Remote Similarity | NPC470385 |
0.6721 | Remote Similarity | NPC470386 |
0.6719 | Remote Similarity | NPC222833 |
0.6719 | Remote Similarity | NPC56656 |
0.6718 | Remote Similarity | NPC94650 |
0.6718 | Remote Similarity | NPC329953 |
0.6716 | Remote Similarity | NPC78836 |
0.6694 | Remote Similarity | NPC10864 |
0.6692 | Remote Similarity | NPC474725 |
0.6692 | Remote Similarity | NPC469744 |
0.6692 | Remote Similarity | NPC274827 |
0.6692 | Remote Similarity | NPC131903 |
0.6667 | Remote Similarity | NPC210214 |
0.6667 | Remote Similarity | NPC252614 |
0.6667 | Remote Similarity | NPC98639 |
0.6667 | Remote Similarity | NPC470232 |
0.6667 | Remote Similarity | NPC146683 |
0.6667 | Remote Similarity | NPC124358 |
0.6667 | Remote Similarity | NPC169375 |
0.6644 | Remote Similarity | NPC141669 |
0.664 | Remote Similarity | NPC89099 |
0.664 | Remote Similarity | NPC98837 |
0.664 | Remote Similarity | NPC20479 |
0.664 | Remote Similarity | NPC474793 |
0.664 | Remote Similarity | NPC109059 |
0.664 | Remote Similarity | NPC288 |
0.664 | Remote Similarity | NPC28864 |
0.664 | Remote Similarity | NPC38296 |
0.664 | Remote Similarity | NPC38471 |
0.664 | Remote Similarity | NPC162459 |
0.6621 | Remote Similarity | NPC145899 |
0.6617 | Remote Similarity | NPC194273 |
0.6615 | Remote Similarity | NPC211224 |
0.6614 | Remote Similarity | NPC476755 |
0.6613 | Remote Similarity | NPC200054 |
0.6613 | Remote Similarity | NPC29410 |
0.6613 | Remote Similarity | NPC470387 |
0.6613 | Remote Similarity | NPC329910 |
0.6597 | Remote Similarity | NPC76999 |
0.6591 | Remote Similarity | NPC56025 |
0.6589 | Remote Similarity | NPC37600 |
0.6587 | Remote Similarity | NPC293866 |
0.6585 | Remote Similarity | NPC277399 |
0.6585 | Remote Similarity | NPC475118 |
0.6581 | Remote Similarity | NPC118800 |
0.6581 | Remote Similarity | NPC291320 |
0.6581 | Remote Similarity | NPC471036 |
0.6562 | Remote Similarity | NPC266 |
0.6562 | Remote Similarity | NPC159442 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC477352 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 |
---|---|---|---|
0.672 | Remote Similarity | NPD8418 | Phase 2 |
0.6644 | Remote Similarity | NPD6333 | Approved |
0.6644 | Remote Similarity | NPD6334 | Approved |
0.6515 | Remote Similarity | NPD4634 | Approved |
0.6286 | Remote Similarity | NPD6921 | Approved |
0.6202 | Remote Similarity | NPD5286 | Approved |
0.6202 | Remote Similarity | NPD4696 | Approved |
0.6202 | Remote Similarity | NPD5285 | Approved |
0.6172 | Remote Similarity | NPD4755 | Approved |
0.6107 | Remote Similarity | NPD5224 | Approved |
0.6107 | Remote Similarity | NPD5211 | Phase 2 |
0.6107 | Remote Similarity | NPD5225 | Approved |
0.6107 | Remote Similarity | NPD4633 | Approved |
0.6107 | Remote Similarity | NPD5226 | Approved |
0.6099 | Remote Similarity | NPD6319 | Approved |
0.6077 | Remote Similarity | NPD4700 | Approved |
0.6061 | Remote Similarity | NPD5174 | Approved |
0.6061 | Remote Similarity | NPD5175 | Approved |
0.6056 | Remote Similarity | NPD6909 | Approved |
0.6056 | Remote Similarity | NPD6908 | Approved |
0.6032 | Remote Similarity | NPD6079 | Approved |
0.6031 | Remote Similarity | NPD5223 | Approved |
0.6015 | Remote Similarity | NPD5141 | Approved |
0.6014 | Remote Similarity | NPD8298 | Phase 2 |
0.6014 | Remote Similarity | NPD4632 | Approved |
0.6 | Remote Similarity | NPD5328 | Approved |
0.6 | Remote Similarity | NPD7115 | Discovery |
0.5986 | Remote Similarity | NPD6054 | Approved |
0.5969 | Remote Similarity | NPD5221 | Approved |
0.5969 | Remote Similarity | NPD5222 | Approved |
0.5969 | Remote Similarity | NPD5220 | Clinical (unspecified phase) |
0.5969 | Remote Similarity | NPD4697 | Phase 3 |
0.5944 | Remote Similarity | NPD6016 | Approved |
0.5944 | Remote Similarity | NPD6015 | Approved |
0.5935 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5926 | Remote Similarity | NPD5697 | Approved |
0.5923 | Remote Similarity | NPD5173 | Approved |
0.5918 | Remote Similarity | NPD7736 | Approved |
0.5906 | Remote Similarity | NPD8035 | Phase 2 |
0.5906 | Remote Similarity | NPD8034 | Phase 2 |
0.5903 | Remote Similarity | NPD5988 | Approved |
0.5903 | Remote Similarity | NPD6370 | Approved |
0.5902 | Remote Similarity | NPD4788 | Approved |
0.5887 | Remote Similarity | NPD3618 | Phase 1 |
0.5882 | Remote Similarity | NPD6881 | Approved |
0.5882 | Remote Similarity | NPD4730 | Approved |
0.5882 | Remote Similarity | NPD6899 | Approved |
0.5882 | Remote Similarity | NPD8174 | Phase 2 |
0.5882 | Remote Similarity | NPD4729 | Approved |
0.5882 | Remote Similarity | NPD5128 | Approved |
0.5882 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.5874 | Remote Similarity | NPD6059 | Approved |
0.587 | Remote Similarity | NPD6649 | Approved |
0.587 | Remote Similarity | NPD6650 | Approved |
0.5862 | Remote Similarity | NPD7604 | Phase 2 |
0.5859 | Remote Similarity | NPD4202 | Approved |
0.5852 | Remote Similarity | NPD5739 | Approved |
0.5852 | Remote Similarity | NPD4767 | Approved |
0.5852 | Remote Similarity | NPD6920 | Discontinued |
0.5852 | Remote Similarity | NPD4768 | Approved |
0.5852 | Remote Similarity | NPD6402 | Approved |
0.5852 | Remote Similarity | NPD7128 | Approved |
0.5852 | Remote Similarity | NPD6675 | Approved |
0.5839 | Remote Similarity | NPD6372 | Approved |
0.5839 | Remote Similarity | NPD6013 | Approved |
0.5839 | Remote Similarity | NPD6014 | Approved |
0.5839 | Remote Similarity | NPD6373 | Approved |
0.5839 | Remote Similarity | NPD6012 | Approved |
0.5827 | Remote Similarity | NPD8297 | Approved |
0.5822 | Remote Similarity | NPD7492 | Approved |
0.5821 | Remote Similarity | NPD4754 | Approved |
0.5809 | Remote Similarity | NPD5701 | Approved |
0.5797 | Remote Similarity | NPD5247 | Approved |
0.5797 | Remote Similarity | NPD5249 | Phase 3 |
0.5797 | Remote Similarity | NPD5250 | Approved |
0.5797 | Remote Similarity | NPD7290 | Approved |
0.5797 | Remote Similarity | NPD5251 | Approved |
0.5797 | Remote Similarity | NPD6883 | Approved |
0.5797 | Remote Similarity | NPD7102 | Approved |
0.5797 | Remote Similarity | NPD5248 | Approved |
0.5782 | Remote Similarity | NPD6616 | Approved |
0.5775 | Remote Similarity | NPD6009 | Approved |
0.5772 | Remote Similarity | NPD7319 | Approved |
0.5766 | Remote Similarity | NPD7320 | Approved |
0.5766 | Remote Similarity | NPD6011 | Approved |
0.5763 | Remote Similarity | NPD3703 | Phase 2 |
0.576 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.5755 | Remote Similarity | NPD5215 | Approved |
0.5755 | Remote Similarity | NPD8130 | Phase 1 |
0.5755 | Remote Similarity | NPD5216 | Approved |
0.5755 | Remote Similarity | NPD6869 | Approved |
0.5755 | Remote Similarity | NPD6617 | Approved |
0.5755 | Remote Similarity | NPD5217 | Approved |
0.5755 | Remote Similarity | NPD6847 | Approved |
0.5753 | Remote Similarity | NPD8328 | Phase 3 |
0.5743 | Remote Similarity | NPD7078 | Approved |
0.5735 | Remote Similarity | NPD6008 | Approved |
0.5733 | Remote Similarity | NPD6914 | Discontinued |
0.5726 | Remote Similarity | NPD4786 | Approved |
0.5714 | Remote Similarity | NPD6882 | Approved |
0.5704 | Remote Similarity | NPD6940 | Discontinued |
0.5693 | Remote Similarity | NPD6412 | Phase 2 |
0.5692 | Remote Similarity | NPD5769 | Clinical (unspecified phase) |
0.5691 | Remote Similarity | NPD3667 | Approved |
0.5683 | Remote Similarity | NPD5134 | Clinical (unspecified phase) |
0.5683 | Remote Similarity | NPD5169 | Approved |
0.5683 | Remote Similarity | NPD5135 | Approved |
0.5676 | Remote Similarity | NPD7507 | Approved |
0.5664 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.5659 | Remote Similarity | NPD7515 | Phase 2 |
0.5655 | Remote Similarity | NPD7148 | Clinical (unspecified phase) |
0.5655 | Remote Similarity | NPD7147 | Phase 3 |
0.5652 | Remote Similarity | NPD6415 | Discontinued |
0.5649 | Remote Similarity | NPD4629 | Approved |
0.5649 | Remote Similarity | NPD5210 | Approved |
0.5643 | Remote Similarity | NPD5127 | Approved |
0.5638 | Remote Similarity | NPD8293 | Discontinued |
0.5625 | Remote Similarity | NPD4753 | Phase 2 |
0.5616 | Remote Similarity | NPD5983 | Phase 2 |
0.5615 | Remote Similarity | NPD6399 | Phase 3 |
0.56 | Remote Similarity | NPD3666 | Approved |
0.56 | Remote Similarity | NPD3133 | Approved |
0.56 | Remote Similarity | NPD3665 | Phase 1 |
PubChem CID   | |
ChEMBL   | CHEMBL3422417 |
ZINC   |
Molecular Weight:   | 361.19 |
ALogP:   | -1.8662 |
MLogP:   | 3 |
XLogP:   | -0.197 |
# Rotatable Bonds:   | 6 |
Polar Surface Area:   | 110.35 |
# H-Bond Aceptor:   | 6 |
# H-Bond Donor:   | 4 |
# Rings:   | 3 |
# Heavy Atoms:   | 26 |