Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT139 | Cell Line | HT-29 | Homo sapiens | IC50 | = | 1980 | nM | 21928797 |
NPT65 | Cell Line | HepG2 | Homo sapiens | IC50 | = | 1730 | nM | 21928797 |
NPT547 | Cell Line | BGC-823 | Homo sapiens | IC50 | = | 1360 | nM | 21928797 |
NPT81 | Cell Line | A549 | Homo sapiens | IC50 | = | 2360 | nM | 21928797 |
NPT1083 | Cell Line | A-375 | Homo sapiens | IC50 | = | 1910 | nM | 21928797 |
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 NPC273189 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 | NPC184805 |
0.9898 | High Similarity | NPC471430 |
0.9897 | High Similarity | NPC267637 |
0.9691 | High Similarity | NPC80640 |
0.9604 | High Similarity | NPC470622 |
0.9604 | High Similarity | NPC66513 |
0.96 | High Similarity | NPC207693 |
0.9505 | High Similarity | NPC87393 |
0.9505 | High Similarity | NPC22709 |
0.9485 | High Similarity | NPC80417 |
0.9231 | High Similarity | NPC157571 |
0.9118 | High Similarity | NPC138219 |
0.9118 | High Similarity | NPC126753 |
0.9118 | High Similarity | NPC475630 |
0.9118 | High Similarity | NPC40716 |
0.9118 | High Similarity | NPC475234 |
0.9029 | High Similarity | NPC473688 |
0.9029 | High Similarity | NPC471626 |
0.9029 | High Similarity | NPC231566 |
0.9029 | High Similarity | NPC262567 |
0.902 | High Similarity | NPC119628 |
0.902 | High Similarity | NPC158051 |
0.902 | High Similarity | NPC158367 |
0.8922 | High Similarity | NPC469827 |
0.8879 | High Similarity | NPC477465 |
0.8857 | High Similarity | NPC471431 |
0.8846 | High Similarity | NPC469826 |
0.88 | High Similarity | NPC209798 |
0.88 | High Similarity | NPC471374 |
0.88 | High Similarity | NPC471375 |
0.8776 | High Similarity | NPC77717 |
0.8776 | High Similarity | NPC471373 |
0.8776 | High Similarity | NPC148593 |
0.8776 | High Similarity | NPC267238 |
0.8776 | High Similarity | NPC253611 |
0.8774 | High Similarity | NPC469824 |
0.8762 | High Similarity | NPC469825 |
0.8725 | High Similarity | NPC80191 |
0.8725 | High Similarity | NPC310031 |
0.8713 | High Similarity | NPC471428 |
0.8713 | High Similarity | NPC51579 |
0.8713 | High Similarity | NPC471426 |
0.8713 | High Similarity | NPC471427 |
0.8687 | High Similarity | NPC189575 |
0.8687 | High Similarity | NPC205129 |
0.8687 | High Similarity | NPC106701 |
0.8687 | High Similarity | NPC471425 |
0.8687 | High Similarity | NPC471424 |
0.8687 | High Similarity | NPC471429 |
0.8673 | High Similarity | NPC224003 |
0.8673 | High Similarity | NPC171741 |
0.8673 | High Similarity | NPC323231 |
0.8673 | High Similarity | NPC470623 |
0.8673 | High Similarity | NPC18724 |
0.8667 | High Similarity | NPC475319 |
0.8667 | High Similarity | NPC202898 |
0.8667 | High Similarity | NPC92890 |
0.8627 | High Similarity | NPC477172 |
0.8585 | High Similarity | NPC220836 |
0.8585 | High Similarity | NPC273002 |
0.8585 | High Similarity | NPC473817 |
0.8585 | High Similarity | NPC92297 |
0.8585 | High Similarity | NPC94086 |
0.8585 | High Similarity | NPC233433 |
0.8545 | High Similarity | NPC179429 |
0.8529 | High Similarity | NPC20028 |
0.8476 | Intermediate Similarity | NPC215408 |
0.8411 | Intermediate Similarity | NPC236753 |
0.8411 | Intermediate Similarity | NPC228190 |
0.8393 | Intermediate Similarity | NPC207738 |
0.8349 | Intermediate Similarity | NPC477492 |
0.8319 | Intermediate Similarity | NPC267694 |
0.8319 | Intermediate Similarity | NPC153673 |
0.8319 | Intermediate Similarity | NPC110385 |
0.8319 | Intermediate Similarity | NPC142151 |
0.8319 | Intermediate Similarity | NPC37860 |
0.8319 | Intermediate Similarity | NPC144644 |
0.8319 | Intermediate Similarity | NPC473645 |
0.8304 | Intermediate Similarity | NPC105800 |
0.8304 | Intermediate Similarity | NPC470513 |
0.8304 | Intermediate Similarity | NPC470514 |
0.8304 | Intermediate Similarity | NPC232237 |
0.8288 | Intermediate Similarity | NPC472718 |
0.8286 | Intermediate Similarity | NPC34562 |
0.8286 | Intermediate Similarity | NPC107385 |
0.8273 | Intermediate Similarity | NPC146563 |
0.8257 | Intermediate Similarity | NPC473062 |
0.8246 | Intermediate Similarity | NPC68767 |
0.8246 | Intermediate Similarity | NPC275225 |
0.8246 | Intermediate Similarity | NPC51099 |
0.8246 | Intermediate Similarity | NPC293031 |
0.8224 | Intermediate Similarity | NPC203974 |
0.8218 | Intermediate Similarity | NPC305418 |
0.8214 | Intermediate Similarity | NPC475119 |
0.8214 | Intermediate Similarity | NPC473824 |
0.8208 | Intermediate Similarity | NPC470167 |
0.8173 | Intermediate Similarity | NPC41843 |
0.8158 | Intermediate Similarity | NPC473130 |
0.8142 | Intermediate Similarity | NPC475899 |
0.8125 | Intermediate Similarity | NPC75287 |
0.8125 | Intermediate Similarity | NPC51465 |
0.8125 | Intermediate Similarity | NPC305267 |
0.8125 | Intermediate Similarity | NPC288205 |
0.8125 | Intermediate Similarity | NPC476992 |
0.8125 | Intermediate Similarity | NPC469823 |
0.8125 | Intermediate Similarity | NPC469820 |
0.8125 | Intermediate Similarity | NPC137414 |
0.8125 | Intermediate Similarity | NPC26626 |
0.8125 | Intermediate Similarity | NPC37134 |
0.8125 | Intermediate Similarity | NPC291903 |
0.81 | Intermediate Similarity | NPC18536 |
0.81 | Intermediate Similarity | NPC50443 |
0.8091 | Intermediate Similarity | NPC275668 |
0.8091 | Intermediate Similarity | NPC11035 |
0.8091 | Intermediate Similarity | NPC240734 |
0.8091 | Intermediate Similarity | NPC1876 |
0.8091 | Intermediate Similarity | NPC204392 |
0.8091 | Intermediate Similarity | NPC91838 |
0.8091 | Intermediate Similarity | NPC274833 |
0.8087 | Intermediate Similarity | NPC470478 |
0.807 | Intermediate Similarity | NPC477464 |
0.807 | Intermediate Similarity | NPC25663 |
0.807 | Intermediate Similarity | NPC135849 |
0.807 | Intermediate Similarity | NPC471577 |
0.807 | Intermediate Similarity | NPC51564 |
0.8058 | Intermediate Similarity | NPC203434 |
0.8058 | Intermediate Similarity | NPC238796 |
0.8058 | Intermediate Similarity | NPC304011 |
0.8058 | Intermediate Similarity | NPC237071 |
0.8058 | Intermediate Similarity | NPC139271 |
0.8053 | Intermediate Similarity | NPC473452 |
0.8053 | Intermediate Similarity | NPC8524 |
0.8053 | Intermediate Similarity | NPC85154 |
0.8053 | Intermediate Similarity | NPC309223 |
0.8053 | Intermediate Similarity | NPC471580 |
0.8053 | Intermediate Similarity | NPC470876 |
0.8053 | Intermediate Similarity | NPC68175 |
0.8053 | Intermediate Similarity | NPC286457 |
0.8053 | Intermediate Similarity | NPC475514 |
0.8053 | Intermediate Similarity | NPC102505 |
0.8053 | Intermediate Similarity | NPC191827 |
0.8053 | Intermediate Similarity | NPC475209 |
0.8053 | Intermediate Similarity | NPC33012 |
0.8053 | Intermediate Similarity | NPC220160 |
0.8053 | Intermediate Similarity | NPC104137 |
0.8053 | Intermediate Similarity | NPC69811 |
0.8053 | Intermediate Similarity | NPC300419 |
0.8053 | Intermediate Similarity | NPC123522 |
0.8041 | Intermediate Similarity | NPC34984 |
0.8041 | Intermediate Similarity | NPC25037 |
0.8036 | Intermediate Similarity | NPC79193 |
0.8036 | Intermediate Similarity | NPC475486 |
0.8036 | Intermediate Similarity | NPC54395 |
0.8036 | Intermediate Similarity | NPC469821 |
0.8036 | Intermediate Similarity | NPC164389 |
0.802 | Intermediate Similarity | NPC307167 |
0.802 | Intermediate Similarity | NPC229801 |
0.802 | Intermediate Similarity | NPC210759 |
0.8018 | Intermediate Similarity | NPC472719 |
0.8018 | Intermediate Similarity | NPC477489 |
0.8018 | Intermediate Similarity | NPC207845 |
0.8 | Intermediate Similarity | NPC131466 |
0.8 | Intermediate Similarity | NPC476991 |
0.7982 | Intermediate Similarity | NPC473459 |
0.7982 | Intermediate Similarity | NPC469822 |
0.7982 | Intermediate Similarity | NPC237191 |
0.7982 | Intermediate Similarity | NPC36831 |
0.7982 | Intermediate Similarity | NPC472079 |
0.7981 | Intermediate Similarity | NPC472273 |
0.7981 | Intermediate Similarity | NPC470591 |
0.7981 | Intermediate Similarity | NPC476112 |
0.7981 | Intermediate Similarity | NPC307534 |
0.7981 | Intermediate Similarity | NPC274200 |
0.7966 | Intermediate Similarity | NPC181066 |
0.7966 | Intermediate Similarity | NPC469947 |
0.7966 | Intermediate Similarity | NPC470218 |
0.7965 | Intermediate Similarity | NPC160415 |
0.7965 | Intermediate Similarity | NPC58448 |
0.7965 | Intermediate Similarity | NPC161674 |
0.7965 | Intermediate Similarity | NPC471384 |
0.7961 | Intermediate Similarity | NPC206003 |
0.7961 | Intermediate Similarity | NPC94582 |
0.7961 | Intermediate Similarity | NPC107962 |
0.7961 | Intermediate Similarity | NPC6295 |
0.7961 | Intermediate Similarity | NPC107188 |
0.7961 | Intermediate Similarity | NPC473727 |
0.7961 | Intermediate Similarity | NPC211354 |
0.7961 | Intermediate Similarity | NPC19400 |
0.7961 | Intermediate Similarity | NPC477494 |
0.7961 | Intermediate Similarity | NPC473610 |
0.7961 | Intermediate Similarity | NPC475351 |
0.7961 | Intermediate Similarity | NPC57964 |
0.7949 | Intermediate Similarity | NPC281148 |
0.7949 | Intermediate Similarity | NPC235405 |
0.7949 | Intermediate Similarity | NPC30735 |
0.7946 | Intermediate Similarity | NPC114287 |
0.7946 | Intermediate Similarity | NPC323341 |
0.7946 | Intermediate Similarity | NPC295823 |
0.7946 | Intermediate Similarity | NPC241909 |
0.7946 | Intermediate Similarity | NPC475467 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC273189 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 |
---|---|---|---|
0.8381 | Intermediate Similarity | NPD8170 | Clinical (unspecified phase) |
0.7788 | Intermediate Similarity | NPD8133 | Approved |
0.7767 | Intermediate Similarity | NPD8171 | Discontinued |
0.7739 | Intermediate Similarity | NPD8295 | Clinical (unspecified phase) |
0.7647 | Intermediate Similarity | NPD8328 | Phase 3 |
0.7589 | Intermediate Similarity | NPD8132 | Clinical (unspecified phase) |
0.6911 | Remote Similarity | NPD8515 | Approved |
0.6911 | Remote Similarity | NPD8516 | Approved |
0.6911 | Remote Similarity | NPD8517 | Approved |
0.6893 | Remote Similarity | NPD3669 | Approved |
0.6893 | Remote Similarity | NPD3670 | Clinical (unspecified phase) |
0.681 | Remote Similarity | NPD6412 | Phase 2 |
0.6774 | Remote Similarity | NPD8513 | Phase 3 |
0.6752 | Remote Similarity | NPD5345 | Clinical (unspecified phase) |
0.6719 | Remote Similarity | NPD7736 | Approved |
0.6699 | Remote Similarity | NPD1779 | Approved |
0.6699 | Remote Similarity | NPD1780 | Approved |
0.6694 | Remote Similarity | NPD8377 | Approved |
0.6694 | Remote Similarity | NPD8294 | Approved |
0.6667 | Remote Similarity | NPD7319 | Approved |
0.664 | Remote Similarity | NPD8379 | Approved |
0.664 | Remote Similarity | NPD8378 | Approved |
0.664 | Remote Similarity | NPD8335 | Approved |
0.664 | Remote Similarity | NPD8380 | Approved |
0.664 | Remote Similarity | NPD8296 | Approved |
0.6639 | Remote Similarity | NPD6940 | Discontinued |
0.6602 | Remote Similarity | NPD6928 | Phase 2 |
0.6587 | Remote Similarity | NPD6370 | Approved |
0.6569 | Remote Similarity | NPD6115 | Approved |
0.6569 | Remote Similarity | NPD6118 | Approved |
0.6569 | Remote Similarity | NPD6114 | Approved |
0.6569 | Remote Similarity | NPD6697 | Approved |
0.6562 | Remote Similarity | NPD7507 | Approved |
0.6512 | Remote Similarity | NPD8293 | Discontinued |
0.6508 | Remote Similarity | NPD8033 | Approved |
0.65 | Remote Similarity | NPD1811 | Approved |
0.65 | Remote Similarity | NPD1810 | Approved |
0.6471 | Remote Similarity | NPD6686 | Approved |
0.6471 | Remote Similarity | NPD6116 | Phase 1 |
0.6466 | Remote Similarity | NPD8138 | Approved |
0.6466 | Remote Similarity | NPD8139 | Approved |
0.6466 | Remote Similarity | NPD8085 | Approved |
0.6466 | Remote Similarity | NPD8086 | Approved |
0.6466 | Remote Similarity | NPD8084 | Approved |
0.6466 | Remote Similarity | NPD8082 | Approved |
0.6466 | Remote Similarity | NPD8083 | Approved |
0.6441 | Remote Similarity | NPD8393 | Approved |
0.6436 | Remote Similarity | NPD3703 | Phase 2 |
0.6429 | Remote Similarity | NPD6054 | Approved |
0.6429 | Remote Similarity | NPD6059 | Approved |
0.641 | Remote Similarity | NPD8276 | Approved |
0.641 | Remote Similarity | NPD8275 | Approved |
0.6396 | Remote Similarity | NPD8035 | Phase 2 |
0.6396 | Remote Similarity | NPD8034 | Phase 2 |
0.6373 | Remote Similarity | NPD6117 | Approved |
0.6356 | Remote Similarity | NPD8081 | Approved |
0.6346 | Remote Similarity | NPD7329 | Approved |
0.6311 | Remote Similarity | NPD8413 | Clinical (unspecified phase) |
0.63 | Remote Similarity | NPD4809 | Clinical (unspecified phase) |
0.63 | Remote Similarity | NPD4808 | Clinical (unspecified phase) |
0.627 | Remote Similarity | NPD7328 | Approved |
0.627 | Remote Similarity | NPD7327 | Approved |
0.6263 | Remote Similarity | NPD3700 | Clinical (unspecified phase) |
0.6263 | Remote Similarity | NPD3699 | Clinical (unspecified phase) |
0.6261 | Remote Similarity | NPD7902 | Approved |
0.625 | Remote Similarity | NPD6016 | Approved |
0.625 | Remote Similarity | NPD6015 | Approved |
0.625 | Remote Similarity | NPD6921 | Approved |
0.6231 | Remote Similarity | NPD7492 | Approved |
0.622 | Remote Similarity | NPD7516 | Approved |
0.6202 | Remote Similarity | NPD5988 | Approved |
0.62 | Remote Similarity | NPD2687 | Approved |
0.62 | Remote Similarity | NPD2254 | Approved |
0.62 | Remote Similarity | NPD2686 | Approved |
0.6183 | Remote Similarity | NPD6616 | Approved |
0.6176 | Remote Similarity | NPD6113 | Clinical (unspecified phase) |
0.614 | Remote Similarity | NPD7748 | Approved |
0.6136 | Remote Similarity | NPD7078 | Approved |
0.6102 | Remote Similarity | NPD1700 | Approved |
0.61 | Remote Similarity | NPD4267 | Clinical (unspecified phase) |
0.6083 | Remote Similarity | NPD4057 | Clinical (unspecified phase) |
0.6083 | Remote Similarity | NPD4056 | Clinical (unspecified phase) |
0.6047 | Remote Similarity | NPD6319 | Approved |
0.604 | Remote Similarity | NPD4244 | Approved |
0.604 | Remote Similarity | NPD7532 | Clinical (unspecified phase) |
0.604 | Remote Similarity | NPD4245 | Approved |
0.6031 | Remote Similarity | NPD6067 | Discontinued |
0.6016 | Remote Similarity | NPD4061 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD7503 | Approved |
0.6 | Remote Similarity | NPD7900 | Approved |
0.6 | Remote Similarity | NPD5360 | Phase 3 |
0.6 | Remote Similarity | NPD7901 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD5361 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD7520 | Clinical (unspecified phase) |
0.5984 | Remote Similarity | NPD8307 | Discontinued |
0.5984 | Remote Similarity | NPD8140 | Approved |
0.597 | Remote Similarity | NPD6033 | Approved |
0.5968 | Remote Similarity | NPD5955 | Clinical (unspecified phase) |
0.5965 | Remote Similarity | NPD7515 | Phase 2 |
0.5948 | Remote Similarity | NPD7991 | Discontinued |
0.5941 | Remote Similarity | NPD3698 | Phase 2 |
0.5938 | Remote Similarity | NPD7115 | Discovery |
0.5922 | Remote Similarity | NPD3181 | Approved |
0.5896 | Remote Similarity | NPD8074 | Phase 3 |
0.5887 | Remote Similarity | NPD8305 | Approved |
0.5887 | Remote Similarity | NPD8306 | Approved |
0.5882 | Remote Similarity | NPD4789 | Approved |
0.5873 | Remote Similarity | NPD8297 | Approved |
0.5873 | Remote Similarity | NPD6882 | Approved |
0.584 | Remote Similarity | NPD8087 | Discontinued |
0.5825 | Remote Similarity | NPD5777 | Approved |
0.5814 | Remote Similarity | NPD6009 | Approved |
0.581 | Remote Similarity | NPD3702 | Approved |
0.5794 | Remote Similarity | NPD4802 | Phase 2 |
0.5794 | Remote Similarity | NPD3671 | Phase 1 |
0.5794 | Remote Similarity | NPD4238 | Approved |
0.5773 | Remote Similarity | NPD6123 | Approved |
0.576 | Remote Similarity | NPD6372 | Approved |
0.576 | Remote Similarity | NPD6373 | Approved |
0.5758 | Remote Similarity | NPD371 | Approved |
0.5755 | Remote Similarity | NPD8450 | Suspended |
0.5726 | Remote Similarity | NPD5954 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4634 | Approved |
0.5703 | Remote Similarity | NPD4632 | Approved |
0.57 | Remote Similarity | NPD3171 | Clinical (unspecified phase) |
0.5692 | Remote Similarity | NPD8137 | Clinical (unspecified phase) |
0.5683 | Remote Similarity | NPD8449 | Approved |
0.5682 | Remote Similarity | NPD8347 | Approved |
0.5682 | Remote Similarity | NPD8346 | Approved |
0.5682 | Remote Similarity | NPD8345 | Approved |
0.568 | Remote Similarity | NPD8174 | Phase 2 |
0.5673 | Remote Similarity | NPD4758 | Discontinued |
0.5673 | Remote Similarity | NPD6081 | Approved |
0.5669 | Remote Similarity | NPD6650 | Approved |
0.5669 | Remote Similarity | NPD6649 | Approved |
0.5667 | Remote Similarity | NPD7638 | Approved |
0.5667 | Remote Similarity | NPD4225 | Approved |
0.5656 | Remote Similarity | NPD8301 | Approved |
0.5656 | Remote Similarity | NPD8300 | Approved |
0.5648 | Remote Similarity | NPD5364 | Discontinued |
0.5645 | Remote Similarity | NPD7128 | Approved |
0.5645 | Remote Similarity | NPD6675 | Approved |
0.5645 | Remote Similarity | NPD5739 | Approved |
0.5645 | Remote Similarity | NPD6402 | Approved |
0.5644 | Remote Similarity | NPD4224 | Phase 2 |
0.5641 | Remote Similarity | NPD6399 | Phase 3 |
0.5639 | Remote Similarity | NPD8269 | Approved |
0.5639 | Remote Similarity | NPD8268 | Approved |
0.5639 | Remote Similarity | NPD8274 | Clinical (unspecified phase) |
0.5639 | Remote Similarity | NPD8267 | Approved |
0.5639 | Remote Similarity | NPD8266 | Approved |
0.562 | Remote Similarity | NPD7639 | Approved |
0.562 | Remote Similarity | NPD7640 | Approved |
0.562 | Remote Similarity | NPD8418 | Phase 2 |
PubChem CID   | 56598062 |
ChEMBL   | CHEMBL1927849 |
ZINC   |
Molecular Weight:   | 1044.55 |
ALogP:   | -4.1046 |
MLogP:   | 4.87 |
XLogP:   | 2.178 |
# Rotatable Bonds:   | 28 |
Polar Surface Area:   | 322.67 |
# H-Bond Aceptor:   | 21 |
# H-Bond Donor:   | 11 |
# Rings:   | 10 |
# Heavy Atoms:   | 73 |