Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT83 | Cell Line | MCF7 | Homo sapiens | IC50 | > | 50 | ug/ml | 10.1007/s00044-013-0496-5 |
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 NPC470009 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 |
---|---|---|
0.8696 | High Similarity | NPC58267 |
0.8696 | High Similarity | NPC261372 |
0.8696 | High Similarity | NPC263674 |
0.8488 | Intermediate Similarity | NPC474266 |
0.8409 | Intermediate Similarity | NPC470657 |
0.8387 | Intermediate Similarity | NPC474297 |
0.8372 | Intermediate Similarity | NPC212340 |
0.8372 | Intermediate Similarity | NPC475849 |
0.8315 | Intermediate Similarity | NPC31349 |
0.8298 | Intermediate Similarity | NPC236580 |
0.8298 | Intermediate Similarity | NPC304445 |
0.828 | Intermediate Similarity | NPC215570 |
0.8256 | Intermediate Similarity | NPC216941 |
0.8214 | Intermediate Similarity | NPC70996 |
0.8061 | Intermediate Similarity | NPC473148 |
0.8049 | Intermediate Similarity | NPC184550 |
0.8049 | Intermediate Similarity | NPC185419 |
0.8041 | Intermediate Similarity | NPC67296 |
0.8021 | Intermediate Similarity | NPC249171 |
0.8021 | Intermediate Similarity | NPC49833 |
0.8 | Intermediate Similarity | NPC176756 |
0.7952 | Intermediate Similarity | NPC291228 |
0.7952 | Intermediate Similarity | NPC308096 |
0.7921 | Intermediate Similarity | NPC167044 |
0.7857 | Intermediate Similarity | NPC478181 |
0.7843 | Intermediate Similarity | NPC217041 |
0.7826 | Intermediate Similarity | NPC33398 |
0.7791 | Intermediate Similarity | NPC188793 |
0.7778 | Intermediate Similarity | NPC80144 |
0.7778 | Intermediate Similarity | NPC292803 |
0.7767 | Intermediate Similarity | NPC182185 |
0.7755 | Intermediate Similarity | NPC20028 |
0.7755 | Intermediate Similarity | NPC473146 |
0.7732 | Intermediate Similarity | NPC328180 |
0.7732 | Intermediate Similarity | NPC472273 |
0.7732 | Intermediate Similarity | NPC278028 |
0.7723 | Intermediate Similarity | NPC215408 |
0.7708 | Intermediate Similarity | NPC167893 |
0.7692 | Intermediate Similarity | NPC478111 |
0.7647 | Intermediate Similarity | NPC469788 |
0.7647 | Intermediate Similarity | NPC290247 |
0.7647 | Intermediate Similarity | NPC469787 |
0.7629 | Intermediate Similarity | NPC475765 |
0.7629 | Intermediate Similarity | NPC475785 |
0.7624 | Intermediate Similarity | NPC114365 |
0.7624 | Intermediate Similarity | NPC177518 |
0.7624 | Intermediate Similarity | NPC123070 |
0.7624 | Intermediate Similarity | NPC18433 |
0.7624 | Intermediate Similarity | NPC169089 |
0.7624 | Intermediate Similarity | NPC18044 |
0.7624 | Intermediate Similarity | NPC88890 |
0.7624 | Intermediate Similarity | NPC132304 |
0.7624 | Intermediate Similarity | NPC154962 |
0.7619 | Intermediate Similarity | NPC98870 |
0.7604 | Intermediate Similarity | NPC470424 |
0.76 | Intermediate Similarity | NPC80191 |
0.76 | Intermediate Similarity | NPC310031 |
0.7596 | Intermediate Similarity | NPC106760 |
0.7586 | Intermediate Similarity | NPC83108 |
0.7586 | Intermediate Similarity | NPC214030 |
0.7582 | Intermediate Similarity | NPC473791 |
0.7579 | Intermediate Similarity | NPC235051 |
0.7576 | Intermediate Similarity | NPC41843 |
0.7573 | Intermediate Similarity | NPC92890 |
0.7573 | Intermediate Similarity | NPC202898 |
0.7573 | Intermediate Similarity | NPC475319 |
0.7561 | Intermediate Similarity | NPC206601 |
0.7549 | Intermediate Similarity | NPC168890 |
0.7549 | Intermediate Similarity | NPC166079 |
0.7527 | Intermediate Similarity | NPC314364 |
0.7527 | Intermediate Similarity | NPC51662 |
0.75 | Intermediate Similarity | NPC92297 |
0.75 | Intermediate Similarity | NPC473817 |
0.75 | Intermediate Similarity | NPC273002 |
0.75 | Intermediate Similarity | NPC477172 |
0.75 | Intermediate Similarity | NPC220836 |
0.75 | Intermediate Similarity | NPC233433 |
0.75 | Intermediate Similarity | NPC94086 |
0.7477 | Intermediate Similarity | NPC79193 |
0.7471 | Intermediate Similarity | NPC279575 |
0.7451 | Intermediate Similarity | NPC100078 |
0.7451 | Intermediate Similarity | NPC470167 |
0.7449 | Intermediate Similarity | NPC116683 |
0.7429 | Intermediate Similarity | NPC114961 |
0.7429 | Intermediate Similarity | NPC27551 |
0.7426 | Intermediate Similarity | NPC470172 |
0.7426 | Intermediate Similarity | NPC94919 |
0.7426 | Intermediate Similarity | NPC213528 |
0.7426 | Intermediate Similarity | NPC244969 |
0.7416 | Intermediate Similarity | NPC170595 |
0.7404 | Intermediate Similarity | NPC220773 |
0.7404 | Intermediate Similarity | NPC224414 |
0.7404 | Intermediate Similarity | NPC278693 |
0.7404 | Intermediate Similarity | NPC472079 |
0.7396 | Intermediate Similarity | NPC475878 |
0.7383 | Intermediate Similarity | NPC102619 |
0.7381 | Intermediate Similarity | NPC285003 |
0.7381 | Intermediate Similarity | NPC241265 |
0.7379 | Intermediate Similarity | NPC41674 |
0.7379 | Intermediate Similarity | NPC469441 |
0.7379 | Intermediate Similarity | NPC306776 |
0.7379 | Intermediate Similarity | NPC228311 |
0.7374 | Intermediate Similarity | NPC471241 |
0.7363 | Intermediate Similarity | NPC311642 |
0.7363 | Intermediate Similarity | NPC102156 |
0.7363 | Intermediate Similarity | NPC100366 |
0.7363 | Intermediate Similarity | NPC164289 |
0.7363 | Intermediate Similarity | NPC242771 |
0.7363 | Intermediate Similarity | NPC148740 |
0.7358 | Intermediate Similarity | NPC469824 |
0.7358 | Intermediate Similarity | NPC473062 |
0.7356 | Intermediate Similarity | NPC179922 |
0.7353 | Intermediate Similarity | NPC473406 |
0.7353 | Intermediate Similarity | NPC475928 |
0.734 | Intermediate Similarity | NPC472396 |
0.734 | Intermediate Similarity | NPC475773 |
0.7339 | Intermediate Similarity | NPC179429 |
0.7327 | Intermediate Similarity | NPC476512 |
0.7327 | Intermediate Similarity | NPC178853 |
0.7327 | Intermediate Similarity | NPC108227 |
0.7327 | Intermediate Similarity | NPC287539 |
0.7327 | Intermediate Similarity | NPC3488 |
0.7327 | Intermediate Similarity | NPC475574 |
0.7327 | Intermediate Similarity | NPC472081 |
0.7326 | Intermediate Similarity | NPC248427 |
0.732 | Intermediate Similarity | NPC161035 |
0.732 | Intermediate Similarity | NPC475307 |
0.7308 | Intermediate Similarity | NPC203974 |
0.73 | Intermediate Similarity | NPC211087 |
0.73 | Intermediate Similarity | NPC37866 |
0.73 | Intermediate Similarity | NPC274695 |
0.7292 | Intermediate Similarity | NPC297474 |
0.7292 | Intermediate Similarity | NPC54065 |
0.7292 | Intermediate Similarity | NPC473542 |
0.729 | Intermediate Similarity | NPC477489 |
0.729 | Intermediate Similarity | NPC243572 |
0.7283 | Intermediate Similarity | NPC2572 |
0.7283 | Intermediate Similarity | NPC29342 |
0.7283 | Intermediate Similarity | NPC111409 |
0.7282 | Intermediate Similarity | NPC469827 |
0.7282 | Intermediate Similarity | NPC473526 |
0.7282 | Intermediate Similarity | NPC473701 |
0.7282 | Intermediate Similarity | NPC88469 |
0.7273 | Intermediate Similarity | NPC237071 |
0.7273 | Intermediate Similarity | NPC193785 |
0.7273 | Intermediate Similarity | NPC296936 |
0.7273 | Intermediate Similarity | NPC203434 |
0.7273 | Intermediate Similarity | NPC238796 |
0.7263 | Intermediate Similarity | NPC221993 |
0.7262 | Intermediate Similarity | NPC50228 |
0.7262 | Intermediate Similarity | NPC97736 |
0.7255 | Intermediate Similarity | NPC4899 |
0.7255 | Intermediate Similarity | NPC310138 |
0.7255 | Intermediate Similarity | NPC474730 |
0.7255 | Intermediate Similarity | NPC177013 |
0.7255 | Intermediate Similarity | NPC114700 |
0.7255 | Intermediate Similarity | NPC470029 |
0.7255 | Intermediate Similarity | NPC35185 |
0.7255 | Intermediate Similarity | NPC134967 |
0.7241 | Intermediate Similarity | NPC215030 |
0.7241 | Intermediate Similarity | NPC477867 |
0.7238 | Intermediate Similarity | NPC329876 |
0.7234 | Intermediate Similarity | NPC471411 |
0.7234 | Intermediate Similarity | NPC471410 |
0.7234 | Intermediate Similarity | NPC64862 |
0.7228 | Intermediate Similarity | NPC470030 |
0.7222 | Intermediate Similarity | NPC146992 |
0.7222 | Intermediate Similarity | NPC200944 |
0.7222 | Intermediate Similarity | NPC73455 |
0.7222 | Intermediate Similarity | NPC22742 |
0.7222 | Intermediate Similarity | NPC477346 |
0.7222 | Intermediate Similarity | NPC85759 |
0.7222 | Intermediate Similarity | NPC158302 |
0.7222 | Intermediate Similarity | NPC477344 |
0.7222 | Intermediate Similarity | NPC294748 |
0.7216 | Intermediate Similarity | NPC474065 |
0.7216 | Intermediate Similarity | NPC133888 |
0.7216 | Intermediate Similarity | NPC5632 |
0.7216 | Intermediate Similarity | NPC57304 |
0.7216 | Intermediate Similarity | NPC29821 |
0.7216 | Intermediate Similarity | NPC35959 |
0.7216 | Intermediate Similarity | NPC293001 |
0.7216 | Intermediate Similarity | NPC149966 |
0.7216 | Intermediate Similarity | NPC171360 |
0.7216 | Intermediate Similarity | NPC63193 |
0.7212 | Intermediate Similarity | NPC170432 |
0.7212 | Intermediate Similarity | NPC127235 |
0.7204 | Intermediate Similarity | NPC18953 |
0.7204 | Intermediate Similarity | NPC474156 |
0.7204 | Intermediate Similarity | NPC291310 |
0.72 | Intermediate Similarity | NPC474182 |
0.72 | Intermediate Similarity | NPC210157 |
0.72 | Intermediate Similarity | NPC74466 |
0.72 | Intermediate Similarity | NPC470591 |
0.72 | Intermediate Similarity | NPC472290 |
0.7196 | Intermediate Similarity | NPC272242 |
0.7191 | Intermediate Similarity | NPC474003 |
0.7188 | Intermediate Similarity | NPC20822 |
0.7188 | Intermediate Similarity | NPC155935 |
0.7184 | Intermediate Similarity | NPC476837 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC470009 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 |
---|---|---|---|
0.7624 | Intermediate Similarity | NPD8170 | Clinical (unspecified phase) |
0.7624 | Intermediate Similarity | NPD4056 | Clinical (unspecified phase) |
0.7624 | Intermediate Similarity | NPD4057 | Clinical (unspecified phase) |
0.7303 | Intermediate Similarity | NPD4238 | Approved |
0.7303 | Intermediate Similarity | NPD4802 | Phase 2 |
0.7143 | Intermediate Similarity | NPD8171 | Discontinued |
0.6981 | Remote Similarity | NPD6412 | Phase 2 |
0.6759 | Remote Similarity | NPD6686 | Approved |
0.6757 | Remote Similarity | NPD8133 | Approved |
0.6737 | Remote Similarity | NPD3670 | Clinical (unspecified phase) |
0.6737 | Remote Similarity | NPD3669 | Approved |
0.6707 | Remote Similarity | NPD3198 | Approved |
0.6697 | Remote Similarity | NPD8132 | Clinical (unspecified phase) |
0.6604 | Remote Similarity | NPD8085 | Approved |
0.6604 | Remote Similarity | NPD8084 | Approved |
0.6604 | Remote Similarity | NPD8082 | Approved |
0.6604 | Remote Similarity | NPD8139 | Approved |
0.6604 | Remote Similarity | NPD8083 | Approved |
0.6604 | Remote Similarity | NPD8086 | Approved |
0.6604 | Remote Similarity | NPD8138 | Approved |
0.6596 | Remote Similarity | NPD6928 | Phase 2 |
0.6555 | Remote Similarity | NPD7507 | Approved |
0.6542 | Remote Similarity | NPD8275 | Approved |
0.6542 | Remote Similarity | NPD8276 | Approved |
0.6526 | Remote Similarity | NPD1780 | Approved |
0.6526 | Remote Similarity | NPD1779 | Approved |
0.6517 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.6514 | Remote Similarity | NPD7899 | Clinical (unspecified phase) |
0.6509 | Remote Similarity | NPD1700 | Approved |
0.6491 | Remote Similarity | NPD6940 | Discontinued |
0.6481 | Remote Similarity | NPD8081 | Approved |
0.6422 | Remote Similarity | NPD8393 | Approved |
0.6413 | Remote Similarity | NPD3702 | Approved |
0.6395 | Remote Similarity | NPD7909 | Approved |
0.6393 | Remote Similarity | NPD7319 | Approved |
0.6383 | Remote Similarity | NPD6115 | Approved |
0.6383 | Remote Similarity | NPD6118 | Approved |
0.6383 | Remote Similarity | NPD6114 | Approved |
0.6383 | Remote Similarity | NPD6697 | Approved |
0.6364 | Remote Similarity | NPD897 | Approved |
0.6364 | Remote Similarity | NPD896 | Approved |
0.6364 | Remote Similarity | NPD898 | Approved |
0.6293 | Remote Similarity | NPD8295 | Clinical (unspecified phase) |
0.6277 | Remote Similarity | NPD6116 | Phase 1 |
0.6264 | Remote Similarity | NPD5777 | Approved |
0.6239 | Remote Similarity | NPD7327 | Approved |
0.6239 | Remote Similarity | NPD7328 | Approved |
0.623 | Remote Similarity | NPD8293 | Discontinued |
0.6216 | Remote Similarity | NPD8307 | Discontinued |
0.6216 | Remote Similarity | NPD8140 | Approved |
0.6195 | Remote Similarity | NPD6371 | Approved |
0.6186 | Remote Similarity | NPD7516 | Approved |
0.6179 | Remote Similarity | NPD7736 | Approved |
0.617 | Remote Similarity | NPD6117 | Approved |
0.6167 | Remote Similarity | NPD6370 | Approved |
0.6154 | Remote Similarity | NPD4244 | Approved |
0.6154 | Remote Similarity | NPD4245 | Approved |
0.6146 | Remote Similarity | NPD7329 | Approved |
0.6145 | Remote Similarity | NPD2267 | Suspended |
0.614 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.6139 | Remote Similarity | NPD4250 | Approved |
0.6139 | Remote Similarity | NPD4251 | Approved |
0.6134 | Remote Similarity | NPD8377 | Approved |
0.6134 | Remote Similarity | NPD8294 | Approved |
0.6129 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.6122 | Remote Similarity | NPD6435 | Approved |
0.6117 | Remote Similarity | NPD6698 | Approved |
0.6117 | Remote Similarity | NPD46 | Approved |
0.6106 | Remote Similarity | NPD8306 | Approved |
0.6106 | Remote Similarity | NPD8305 | Approved |
0.6098 | Remote Similarity | NPD3728 | Approved |
0.6098 | Remote Similarity | NPD3730 | Approved |
0.6098 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.6083 | Remote Similarity | NPD8379 | Approved |
0.6083 | Remote Similarity | NPD8335 | Approved |
0.6083 | Remote Similarity | NPD8380 | Approved |
0.6083 | Remote Similarity | NPD8296 | Approved |
0.6083 | Remote Similarity | NPD8378 | Approved |
0.6083 | Remote Similarity | NPD8033 | Approved |
0.6066 | Remote Similarity | NPD7492 | Approved |
0.6053 | Remote Similarity | NPD8087 | Discontinued |
0.6044 | Remote Similarity | NPD3698 | Phase 2 |
0.604 | Remote Similarity | NPD4249 | Approved |
0.6022 | Remote Similarity | NPD3181 | Approved |
0.6016 | Remote Similarity | NPD6616 | Approved |
0.6 | Remote Similarity | NPD6059 | Approved |
0.6 | Remote Similarity | NPD6054 | Approved |
0.5984 | Remote Similarity | NPD6067 | Discontinued |
0.5984 | Remote Similarity | NPD8328 | Phase 3 |
0.5976 | Remote Similarity | NPD894 | Approved |
0.5976 | Remote Similarity | NPD895 | Approved |
0.5976 | Remote Similarity | NPD889 | Approved |
0.5976 | Remote Similarity | NPD887 | Approved |
0.5968 | Remote Similarity | NPD7078 | Approved |
0.5957 | Remote Similarity | NPD1810 | Approved |
0.5957 | Remote Similarity | NPD1811 | Approved |
0.595 | Remote Similarity | NPD8516 | Approved |
0.595 | Remote Similarity | NPD8515 | Approved |
0.595 | Remote Similarity | NPD8517 | Approved |
0.595 | Remote Similarity | NPD7503 | Approved |
0.595 | Remote Similarity | NPD8513 | Phase 3 |
0.5934 | Remote Similarity | NPD229 | Approved |
0.5918 | Remote Similarity | NPD5368 | Approved |
0.5895 | Remote Similarity | NPD2257 | Approved |
0.5882 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5877 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.5859 | Remote Similarity | NPD5369 | Approved |
0.5854 | Remote Similarity | NPD2269 | Approved |
0.582 | Remote Similarity | NPD6015 | Approved |
0.582 | Remote Similarity | NPD6016 | Approved |
0.5812 | Remote Similarity | NPD6882 | Approved |
0.5794 | Remote Similarity | NPD5282 | Discontinued |
0.5778 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.5772 | Remote Similarity | NPD5988 | Approved |
0.5758 | Remote Similarity | NPD5790 | Clinical (unspecified phase) |
0.5755 | Remote Similarity | NPD7983 | Approved |
0.5755 | Remote Similarity | NPD8035 | Phase 2 |
0.5755 | Remote Similarity | NPD8034 | Phase 2 |
0.575 | Remote Similarity | NPD6009 | Approved |
0.5745 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.5745 | Remote Similarity | NPD6081 | Approved |
0.5745 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.5743 | Remote Similarity | NPD5362 | Discontinued |
0.5741 | Remote Similarity | NPD7991 | Discontinued |
0.5741 | Remote Similarity | NPD1698 | Clinical (unspecified phase) |
0.5738 | Remote Similarity | NPD6319 | Approved |
0.5732 | Remote Similarity | NPD904 | Phase 3 |
0.5732 | Remote Similarity | NPD905 | Approved |
0.573 | Remote Similarity | NPD8961 | Approved |
0.5729 | Remote Similarity | NPD3703 | Phase 2 |
0.5714 | Remote Similarity | NPD8301 | Approved |
0.5714 | Remote Similarity | NPD1695 | Approved |
0.5714 | Remote Similarity | NPD8300 | Approved |
0.5702 | Remote Similarity | NPD7641 | Discontinued |
0.5701 | Remote Similarity | NPD6399 | Phase 3 |
0.5699 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.5699 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.5691 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.569 | Remote Similarity | NPD6372 | Approved |
0.569 | Remote Similarity | NPD6373 | Approved |
0.5678 | Remote Similarity | NPD6053 | Discontinued |
0.5678 | Remote Similarity | NPD8297 | Approved |
0.566 | Remote Similarity | NPD5785 | Approved |
0.5645 | Remote Similarity | NPD8080 | Discontinued |
0.5644 | Remote Similarity | NPD4269 | Approved |
0.5644 | Remote Similarity | NPD4270 | Approved |
0.5638 | Remote Similarity | NPD2687 | Approved |
0.5638 | Remote Similarity | NPD2254 | Approved |
0.5638 | Remote Similarity | NPD4789 | Approved |
0.5638 | Remote Similarity | NPD2686 | Approved |
0.5636 | Remote Similarity | NPD6084 | Phase 2 |
0.5636 | Remote Similarity | NPD6083 | Phase 2 |
0.5631 | Remote Similarity | NPD6082 | Clinical (unspecified phase) |
0.563 | Remote Similarity | NPD4632 | Approved |
0.5619 | Remote Similarity | NPD4264 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD8345 | Approved |
0.561 | Remote Similarity | NPD8347 | Approved |
0.561 | Remote Similarity | NPD8346 | Approved |
0.5604 | Remote Similarity | NPD9496 | Clinical (unspecified phase) |
0.5603 | Remote Similarity | NPD7320 | Approved |
0.56 | Remote Similarity | NPD4820 | Approved |
0.56 | Remote Similarity | NPD4819 | Approved |
0.56 | Remote Similarity | NPD4821 | Approved |
0.56 | Remote Similarity | NPD4822 | Approved |
PubChem CID   | 53321860 |
ChEMBL   | CHEMBL1644097 |
ZINC   |
Molecular Weight:   | 414.23 |
ALogP:   | -1.4947 |
MLogP:   | 2.89 |
XLogP:   | 1.38 |
# Rotatable Bonds:   | 10 |
Polar Surface Area:   | 125.68 |
# H-Bond Aceptor:   | 8 |
# H-Bond Donor:   | 4 |
# Rings:   | 4 |
# Heavy Atoms:   | 29 |