Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 22276679 | |
NPT2 | Others | Unspecified | Inhibition | = | 7.3 | % | 19620329 | |
NPT2 | Others | Unspecified | IC50 | > | 10000 | nM | 25136754 | |
NPT2 | Others | Unspecified | Inhibition | = | 5.02 | % | PubChem BioAssay data set |
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 NPC471377 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 |
---|---|---|
0.9877 | High Similarity | NPC279260 |
0.9877 | High Similarity | NPC246347 |
0.9753 | High Similarity | NPC93616 |
0.8889 | High Similarity | NPC43463 |
0.8795 | High Similarity | NPC211049 |
0.8675 | High Similarity | NPC186594 |
0.8642 | High Similarity | NPC136424 |
0.8571 | High Similarity | NPC119922 |
0.8571 | High Similarity | NPC116320 |
0.8471 | Intermediate Similarity | NPC216800 |
0.8434 | Intermediate Similarity | NPC252483 |
0.8434 | Intermediate Similarity | NPC191345 |
0.8313 | Intermediate Similarity | NPC476719 |
0.8256 | Intermediate Similarity | NPC470155 |
0.8256 | Intermediate Similarity | NPC477447 |
0.8256 | Intermediate Similarity | NPC477446 |
0.814 | Intermediate Similarity | NPC470156 |
0.814 | Intermediate Similarity | NPC470154 |
0.809 | Intermediate Similarity | NPC228593 |
0.809 | Intermediate Similarity | NPC235196 |
0.7831 | Intermediate Similarity | NPC476718 |
0.7816 | Intermediate Similarity | NPC472951 |
0.7816 | Intermediate Similarity | NPC472943 |
0.7778 | Intermediate Similarity | NPC476715 |
0.7742 | Intermediate Similarity | NPC470262 |
0.7717 | Intermediate Similarity | NPC470260 |
0.7717 | Intermediate Similarity | NPC75443 |
0.766 | Intermediate Similarity | NPC91251 |
0.766 | Intermediate Similarity | NPC41838 |
0.7609 | Intermediate Similarity | NPC213658 |
0.7609 | Intermediate Similarity | NPC110365 |
0.7609 | Intermediate Similarity | NPC62202 |
0.7609 | Intermediate Similarity | NPC44538 |
0.7609 | Intermediate Similarity | NPC45833 |
0.7553 | Intermediate Similarity | NPC471378 |
0.7553 | Intermediate Similarity | NPC312471 |
0.75 | Intermediate Similarity | NPC475684 |
0.75 | Intermediate Similarity | NPC155531 |
0.75 | Intermediate Similarity | NPC215968 |
0.75 | Intermediate Similarity | NPC477283 |
0.7474 | Intermediate Similarity | NPC122057 |
0.7473 | Intermediate Similarity | NPC18953 |
0.7447 | Intermediate Similarity | NPC161560 |
0.7447 | Intermediate Similarity | NPC291875 |
0.7444 | Intermediate Similarity | NPC60018 |
0.7444 | Intermediate Similarity | NPC202688 |
0.7444 | Intermediate Similarity | NPC154043 |
0.7412 | Intermediate Similarity | NPC123122 |
0.7396 | Intermediate Similarity | NPC475307 |
0.7391 | Intermediate Similarity | NPC471379 |
0.7391 | Intermediate Similarity | NPC266651 |
0.7391 | Intermediate Similarity | NPC196911 |
0.734 | Intermediate Similarity | NPC92370 |
0.734 | Intermediate Similarity | NPC476435 |
0.734 | Intermediate Similarity | NPC476724 |
0.734 | Intermediate Similarity | NPC476723 |
0.734 | Intermediate Similarity | NPC470872 |
0.7333 | Intermediate Similarity | NPC156248 |
0.7333 | Intermediate Similarity | NPC118116 |
0.7333 | Intermediate Similarity | NPC11491 |
0.7333 | Intermediate Similarity | NPC140409 |
0.7326 | Intermediate Similarity | NPC470151 |
0.7312 | Intermediate Similarity | NPC471410 |
0.7312 | Intermediate Similarity | NPC471411 |
0.7292 | Intermediate Similarity | NPC312805 |
0.7264 | Intermediate Similarity | NPC170294 |
0.7241 | Intermediate Similarity | NPC472952 |
0.7241 | Intermediate Similarity | NPC472950 |
0.7234 | Intermediate Similarity | NPC5943 |
0.7188 | Intermediate Similarity | NPC470114 |
0.7174 | Intermediate Similarity | NPC5958 |
0.7174 | Intermediate Similarity | NPC69953 |
0.7174 | Intermediate Similarity | NPC111582 |
0.7174 | Intermediate Similarity | NPC477285 |
0.7174 | Intermediate Similarity | NPC239308 |
0.7158 | Intermediate Similarity | NPC476379 |
0.7143 | Intermediate Similarity | NPC128210 |
0.713 | Intermediate Similarity | NPC89018 |
0.7129 | Intermediate Similarity | NPC272223 |
0.7128 | Intermediate Similarity | NPC476717 |
0.7128 | Intermediate Similarity | NPC131365 |
0.7113 | Intermediate Similarity | NPC473066 |
0.7065 | Intermediate Similarity | NPC286719 |
0.7065 | Intermediate Similarity | NPC477286 |
0.7065 | Intermediate Similarity | NPC477284 |
0.7064 | Intermediate Similarity | NPC226608 |
0.7064 | Intermediate Similarity | NPC88867 |
0.7041 | Intermediate Similarity | NPC256104 |
0.7041 | Intermediate Similarity | NPC182740 |
0.7041 | Intermediate Similarity | NPC211845 |
0.7041 | Intermediate Similarity | NPC122083 |
0.7033 | Intermediate Similarity | NPC474714 |
0.7033 | Intermediate Similarity | NPC186588 |
0.703 | Intermediate Similarity | NPC152480 |
0.7021 | Intermediate Similarity | NPC476725 |
0.7021 | Intermediate Similarity | NPC477445 |
0.7021 | Intermediate Similarity | NPC235402 |
0.7 | Intermediate Similarity | NPC470466 |
0.6989 | Remote Similarity | NPC476721 |
0.6989 | Remote Similarity | NPC2572 |
0.6989 | Remote Similarity | NPC127917 |
0.6989 | Remote Similarity | NPC29342 |
0.6989 | Remote Similarity | NPC241959 |
0.6989 | Remote Similarity | NPC470261 |
0.6979 | Remote Similarity | NPC471221 |
0.6979 | Remote Similarity | NPC56777 |
0.6979 | Remote Similarity | NPC201607 |
0.6961 | Remote Similarity | NPC188968 |
0.6957 | Remote Similarity | NPC190940 |
0.6957 | Remote Similarity | NPC77003 |
0.6952 | Remote Similarity | NPC470263 |
0.6947 | Remote Similarity | NPC268633 |
0.6947 | Remote Similarity | NPC64862 |
0.6939 | Remote Similarity | NPC219516 |
0.6932 | Remote Similarity | NPC166250 |
0.6932 | Remote Similarity | NPC472944 |
0.6932 | Remote Similarity | NPC472945 |
0.6931 | Remote Similarity | NPC111348 |
0.6923 | Remote Similarity | NPC477282 |
0.6923 | Remote Similarity | NPC81074 |
0.69 | Remote Similarity | NPC94582 |
0.69 | Remote Similarity | NPC57964 |
0.6882 | Remote Similarity | NPC103171 |
0.6882 | Remote Similarity | NPC208912 |
0.6882 | Remote Similarity | NPC2096 |
0.6848 | Remote Similarity | NPC471217 |
0.6848 | Remote Similarity | NPC16449 |
0.6848 | Remote Similarity | NPC471216 |
0.6837 | Remote Similarity | NPC18536 |
0.6837 | Remote Similarity | NPC50443 |
0.6837 | Remote Similarity | NPC475056 |
0.6832 | Remote Similarity | NPC116683 |
0.6832 | Remote Similarity | NPC238796 |
0.6832 | Remote Similarity | NPC169270 |
0.6832 | Remote Similarity | NPC292718 |
0.6832 | Remote Similarity | NPC203434 |
0.6832 | Remote Similarity | NPC111834 |
0.6832 | Remote Similarity | NPC306797 |
0.6832 | Remote Similarity | NPC237071 |
0.6832 | Remote Similarity | NPC235109 |
0.6824 | Remote Similarity | NPC476928 |
0.6813 | Remote Similarity | NPC272841 |
0.6809 | Remote Similarity | NPC474253 |
0.6809 | Remote Similarity | NPC475820 |
0.6809 | Remote Similarity | NPC213737 |
0.6809 | Remote Similarity | NPC474346 |
0.6809 | Remote Similarity | NPC474284 |
0.6804 | Remote Similarity | NPC309656 |
0.68 | Remote Similarity | NPC151214 |
0.68 | Remote Similarity | NPC191915 |
0.6796 | Remote Similarity | NPC51579 |
0.6778 | Remote Similarity | NPC293223 |
0.6774 | Remote Similarity | NPC71541 |
0.6774 | Remote Similarity | NPC73515 |
0.6774 | Remote Similarity | NPC475743 |
0.6771 | Remote Similarity | NPC114378 |
0.6771 | Remote Similarity | NPC474008 |
0.6771 | Remote Similarity | NPC103782 |
0.6771 | Remote Similarity | NPC107603 |
0.6765 | Remote Similarity | NPC274793 |
0.6759 | Remote Similarity | NPC322912 |
0.6739 | Remote Similarity | NPC477287 |
0.6739 | Remote Similarity | NPC476176 |
0.6737 | Remote Similarity | NPC473299 |
0.6737 | Remote Similarity | NPC477434 |
0.6737 | Remote Similarity | NPC320824 |
0.6735 | Remote Similarity | NPC477443 |
0.6735 | Remote Similarity | NPC477440 |
0.6733 | Remote Similarity | NPC476720 |
0.6733 | Remote Similarity | NPC292178 |
0.6733 | Remote Similarity | NPC241047 |
0.6733 | Remote Similarity | NPC82633 |
0.6733 | Remote Similarity | NPC86893 |
0.6731 | Remote Similarity | NPC49532 |
0.6731 | Remote Similarity | NPC475574 |
0.6729 | Remote Similarity | NPC319438 |
0.6729 | Remote Similarity | NPC216636 |
0.6726 | Remote Similarity | NPC476714 |
0.6703 | Remote Similarity | NPC64081 |
0.6703 | Remote Similarity | NPC474574 |
0.6703 | Remote Similarity | NPC11907 |
0.6703 | Remote Similarity | NPC133596 |
0.6701 | Remote Similarity | NPC472396 |
0.6699 | Remote Similarity | NPC471374 |
0.6699 | Remote Similarity | NPC292775 |
0.6699 | Remote Similarity | NPC209798 |
0.6699 | Remote Similarity | NPC472144 |
0.6699 | Remote Similarity | NPC471375 |
0.6667 | Remote Similarity | NPC475765 |
0.6667 | Remote Similarity | NPC477442 |
0.6667 | Remote Similarity | NPC36479 |
0.6667 | Remote Similarity | NPC243027 |
0.6667 | Remote Similarity | NPC94897 |
0.6667 | Remote Similarity | NPC185529 |
0.6667 | Remote Similarity | NPC478111 |
0.6667 | Remote Similarity | NPC186851 |
0.6667 | Remote Similarity | NPC470833 |
0.6667 | Remote Similarity | NPC477433 |
0.6667 | Remote Similarity | NPC129569 |
0.6667 | Remote Similarity | NPC472146 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC471377 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 |
---|---|---|---|
0.7176 | Intermediate Similarity | NPD7532 | Clinical (unspecified phase) |
0.6867 | Remote Similarity | NPD371 | Approved |
0.6289 | Remote Similarity | NPD3670 | Clinical (unspecified phase) |
0.6289 | Remote Similarity | NPD3669 | Approved |
0.6111 | Remote Similarity | NPD1700 | Approved |
0.6111 | Remote Similarity | NPD4267 | Clinical (unspecified phase) |
0.6111 | Remote Similarity | NPD5344 | Discontinued |
0.6105 | Remote Similarity | NPD6697 | Approved |
0.6105 | Remote Similarity | NPD6118 | Approved |
0.6105 | Remote Similarity | NPD6115 | Approved |
0.6105 | Remote Similarity | NPD6114 | Approved |
0.6071 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.6058 | Remote Similarity | NPD8171 | Discontinued |
0.6055 | Remote Similarity | NPD3653 | Clinical (unspecified phase) |
0.6022 | Remote Similarity | NPD1811 | Approved |
0.6022 | Remote Similarity | NPD1810 | Approved |
0.6018 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD6116 | Phase 1 |
0.5895 | Remote Similarity | NPD6117 | Approved |
0.5877 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.5833 | Remote Similarity | NPD7516 | Approved |
0.5826 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.5816 | Remote Similarity | NPD6928 | Phase 2 |
0.5804 | Remote Similarity | NPD8170 | Clinical (unspecified phase) |
0.5795 | Remote Similarity | NPD847 | Phase 1 |
0.575 | Remote Similarity | NPD7327 | Approved |
0.575 | Remote Similarity | NPD7328 | Approved |
0.5738 | Remote Similarity | NPD5983 | Phase 2 |
0.5727 | Remote Similarity | NPD6648 | Approved |
0.5699 | Remote Similarity | NPD2254 | Approved |
0.5699 | Remote Similarity | NPD2687 | Approved |
0.5699 | Remote Similarity | NPD2686 | Approved |
0.5684 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.568 | Remote Similarity | NPD6336 | Discontinued |
0.5678 | Remote Similarity | NPD4632 | Approved |
0.5678 | Remote Similarity | NPD8133 | Approved |
0.561 | Remote Similarity | NPD8296 | Approved |
0.561 | Remote Similarity | NPD8335 | Approved |
0.561 | Remote Similarity | NPD8380 | Approved |
0.561 | Remote Similarity | NPD8378 | Approved |
0.561 | Remote Similarity | NPD8379 | Approved |
0.561 | Remote Similarity | NPD6921 | Approved |
0.56 | Remote Similarity | NPD1780 | Approved |
0.56 | Remote Similarity | NPD1779 | Approved |
PubChem CID   | 73347721 |
ChEMBL   | CHEMBL2426309 |
ZINC   |
Molecular Weight:   | 548.24 |
ALogP:   | -1.3726 |
MLogP:   | 3.11 |
XLogP:   | 2.944 |
# Rotatable Bonds:   | 19 |
Polar Surface Area:   | 148.82 |
# H-Bond Aceptor:   | 10 |
# H-Bond Donor:   | 3 |
# Rings:   | 3 |
# Heavy Atoms:   | 37 |