Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT5077 | Individual Protein | Cathepsin B | Bos taurus | IC50 | = | 29000 | nM | 24960234 |
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 NPC478017 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 | NPC315535 |
1.0 | High Similarity | NPC315131 |
0.9861 | High Similarity | NPC316242 |
0.8462 | Intermediate Similarity | NPC473984 |
0.8072 | Intermediate Similarity | NPC227051 |
0.7952 | Intermediate Similarity | NPC155670 |
0.7952 | Intermediate Similarity | NPC95478 |
0.7952 | Intermediate Similarity | NPC145748 |
0.7949 | Intermediate Similarity | NPC86064 |
0.7831 | Intermediate Similarity | NPC477730 |
0.7821 | Intermediate Similarity | NPC43219 |
0.7816 | Intermediate Similarity | NPC477729 |
0.7662 | Intermediate Similarity | NPC478256 |
0.7532 | Intermediate Similarity | NPC473985 |
0.7532 | Intermediate Similarity | NPC475808 |
0.7532 | Intermediate Similarity | NPC474299 |
0.7532 | Intermediate Similarity | NPC28348 |
0.7532 | Intermediate Similarity | NPC474298 |
0.7471 | Intermediate Similarity | NPC477728 |
0.7209 | Intermediate Similarity | NPC47135 |
0.7111 | Intermediate Similarity | NPC193386 |
0.7089 | Intermediate Similarity | NPC472579 |
0.6988 | Remote Similarity | NPC476324 |
0.6988 | Remote Similarity | NPC476130 |
0.6977 | Remote Similarity | NPC314466 |
0.6962 | Remote Similarity | NPC195165 |
0.6962 | Remote Similarity | NPC470110 |
0.6951 | Remote Similarity | NPC138435 |
0.6947 | Remote Similarity | NPC134504 |
0.6947 | Remote Similarity | NPC47076 |
0.6892 | Remote Similarity | NPC472578 |
0.6882 | Remote Similarity | NPC315237 |
0.6835 | Remote Similarity | NPC470109 |
0.6829 | Remote Similarity | NPC477641 |
0.6829 | Remote Similarity | NPC141325 |
0.6829 | Remote Similarity | NPC320865 |
0.6829 | Remote Similarity | NPC477643 |
0.679 | Remote Similarity | NPC476285 |
0.6709 | Remote Similarity | NPC470108 |
0.6707 | Remote Similarity | NPC477200 |
0.6706 | Remote Similarity | NPC472594 |
0.6667 | Remote Similarity | NPC314273 |
0.6667 | Remote Similarity | NPC193280 |
0.6633 | Remote Similarity | NPC220234 |
0.6627 | Remote Similarity | NPC474403 |
0.6602 | Remote Similarity | NPC67009 |
0.6585 | Remote Similarity | NPC477642 |
0.6585 | Remote Similarity | NPC476291 |
0.6556 | Remote Similarity | NPC320936 |
0.6538 | Remote Similarity | NPC329305 |
0.6526 | Remote Similarity | NPC208537 |
0.6526 | Remote Similarity | NPC270005 |
0.65 | Remote Similarity | NPC322319 |
0.65 | Remote Similarity | NPC326651 |
0.65 | Remote Similarity | NPC325117 |
0.6489 | Remote Similarity | NPC39290 |
0.6489 | Remote Similarity | NPC159369 |
0.6471 | Remote Similarity | NPC472595 |
0.6444 | Remote Similarity | NPC474312 |
0.6436 | Remote Similarity | NPC124554 |
0.6436 | Remote Similarity | NPC301148 |
0.6436 | Remote Similarity | NPC5864 |
0.6429 | Remote Similarity | NPC478015 |
0.6429 | Remote Similarity | NPC478016 |
0.6429 | Remote Similarity | NPC478014 |
0.6375 | Remote Similarity | NPC314103 |
0.6373 | Remote Similarity | NPC198344 |
0.6364 | Remote Similarity | NPC321468 |
0.6364 | Remote Similarity | NPC327748 |
0.6351 | Remote Similarity | NPC270041 |
0.6329 | Remote Similarity | NPC145627 |
0.6316 | Remote Similarity | NPC317147 |
0.6311 | Remote Similarity | NPC124549 |
0.6301 | Remote Similarity | NPC322946 |
0.63 | Remote Similarity | NPC234542 |
0.6296 | Remote Similarity | NPC476330 |
0.6289 | Remote Similarity | NPC226513 |
0.6286 | Remote Similarity | NPC475150 |
0.6282 | Remote Similarity | NPC329564 |
0.6282 | Remote Similarity | NPC327170 |
0.6282 | Remote Similarity | NPC470363 |
0.625 | Remote Similarity | NPC80350 |
0.625 | Remote Similarity | NPC37681 |
0.625 | Remote Similarity | NPC474552 |
0.6239 | Remote Similarity | NPC50694 |
0.6238 | Remote Similarity | NPC473224 |
0.6226 | Remote Similarity | NPC473578 |
0.6224 | Remote Similarity | NPC470283 |
0.6211 | Remote Similarity | NPC322966 |
0.618 | Remote Similarity | NPC51695 |
0.618 | Remote Similarity | NPC253703 |
0.618 | Remote Similarity | NPC200085 |
0.618 | Remote Similarity | NPC314858 |
0.6164 | Remote Similarity | NPC90904 |
0.6163 | Remote Similarity | NPC476248 |
0.6161 | Remote Similarity | NPC477237 |
0.6154 | Remote Similarity | NPC74035 |
0.6154 | Remote Similarity | NPC53858 |
0.6154 | Remote Similarity | NPC254541 |
0.6154 | Remote Similarity | NPC320598 |
0.6154 | Remote Similarity | NPC317143 |
0.6154 | Remote Similarity | NPC84128 |
0.6154 | Remote Similarity | NPC316826 |
0.6136 | Remote Similarity | NPC330017 |
0.6132 | Remote Similarity | NPC171734 |
0.6129 | Remote Similarity | NPC277918 |
0.6129 | Remote Similarity | NPC476523 |
0.6126 | Remote Similarity | NPC201968 |
0.6125 | Remote Similarity | NPC327252 |
0.6117 | Remote Similarity | NPC227622 |
0.6111 | Remote Similarity | NPC474702 |
0.6104 | Remote Similarity | NPC318260 |
0.6098 | Remote Similarity | NPC474402 |
0.6091 | Remote Similarity | NPC471645 |
0.6076 | Remote Similarity | NPC475821 |
0.6055 | Remote Similarity | NPC469865 |
0.6053 | Remote Similarity | NPC477238 |
0.6049 | Remote Similarity | NPC145658 |
0.6047 | Remote Similarity | NPC315897 |
0.6042 | Remote Similarity | NPC292345 |
0.6026 | Remote Similarity | NPC189301 |
0.6026 | Remote Similarity | NPC176164 |
0.6022 | Remote Similarity | NPC472351 |
0.6 | Remote Similarity | NPC137327 |
0.6 | Remote Similarity | NPC14537 |
0.6 | Remote Similarity | NPC477644 |
0.5963 | Remote Similarity | NPC476875 |
0.5952 | Remote Similarity | NPC469925 |
0.5949 | Remote Similarity | NPC321536 |
0.5946 | Remote Similarity | NPC329181 |
0.5946 | Remote Similarity | NPC319110 |
0.5943 | Remote Similarity | NPC473252 |
0.5905 | Remote Similarity | NPC476877 |
0.589 | Remote Similarity | NPC131770 |
0.589 | Remote Similarity | NPC200618 |
0.5888 | Remote Similarity | NPC137453 |
0.5888 | Remote Similarity | NPC475800 |
0.5882 | Remote Similarity | NPC126779 |
0.5882 | Remote Similarity | NPC319007 |
0.5876 | Remote Similarity | NPC470284 |
0.5875 | Remote Similarity | NPC471129 |
0.5875 | Remote Similarity | NPC143722 |
0.5875 | Remote Similarity | NPC472020 |
0.5875 | Remote Similarity | NPC472019 |
0.5875 | Remote Similarity | NPC226602 |
0.587 | Remote Similarity | NPC23984 |
0.5851 | Remote Similarity | NPC323180 |
0.5849 | Remote Similarity | NPC128303 |
0.5849 | Remote Similarity | NPC323720 |
0.5844 | Remote Similarity | NPC322573 |
0.5843 | Remote Similarity | NPC228411 |
0.5833 | Remote Similarity | NPC118524 |
0.5833 | Remote Similarity | NPC315525 |
0.5833 | Remote Similarity | NPC135043 |
0.5824 | Remote Similarity | NPC469492 |
0.5816 | Remote Similarity | NPC474593 |
0.5816 | Remote Similarity | NPC475801 |
0.581 | Remote Similarity | NPC72401 |
0.581 | Remote Similarity | NPC325339 |
0.5806 | Remote Similarity | NPC246005 |
0.5802 | Remote Similarity | NPC472021 |
0.5794 | Remote Similarity | NPC476876 |
0.5794 | Remote Similarity | NPC241394 |
0.5794 | Remote Similarity | NPC475918 |
0.5789 | Remote Similarity | NPC263065 |
0.5789 | Remote Similarity | NPC477199 |
0.5789 | Remote Similarity | NPC175419 |
0.5789 | Remote Similarity | NPC189178 |
0.5784 | Remote Similarity | NPC473597 |
0.5783 | Remote Similarity | NPC41429 |
0.578 | Remote Similarity | NPC474725 |
0.5776 | Remote Similarity | NPC160688 |
0.5769 | Remote Similarity | NPC233932 |
0.5765 | Remote Similarity | NPC306696 |
0.5763 | Remote Similarity | NPC470650 |
0.5763 | Remote Similarity | NPC470654 |
0.5763 | Remote Similarity | NPC470653 |
0.5761 | Remote Similarity | NPC469517 |
0.5758 | Remote Similarity | NPC474576 |
0.5755 | Remote Similarity | NPC474563 |
0.5753 | Remote Similarity | NPC319709 |
0.5753 | Remote Similarity | NPC324004 |
0.5753 | Remote Similarity | NPC289484 |
0.5753 | Remote Similarity | NPC21844 |
0.5753 | Remote Similarity | NPC328497 |
0.575 | Remote Similarity | NPC473599 |
0.5747 | Remote Similarity | NPC170963 |
0.5747 | Remote Similarity | NPC470268 |
0.5747 | Remote Similarity | NPC114640 |
0.5747 | Remote Similarity | NPC306973 |
0.5747 | Remote Similarity | NPC126366 |
0.5747 | Remote Similarity | NPC33267 |
0.5747 | Remote Similarity | NPC169976 |
0.5747 | Remote Similarity | NPC324165 |
0.5732 | Remote Similarity | NPC469923 |
0.5714 | Remote Similarity | NPC191774 |
0.5714 | Remote Similarity | NPC477145 |
0.5714 | Remote Similarity | NPC316889 |
0.5714 | Remote Similarity | NPC42320 |
0.5714 | Remote Similarity | NPC473741 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC478017 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 |
---|---|---|---|
1.0 | High Similarity | NPD7918 | Clinical (unspecified phase) |
1.0 | High Similarity | NPD7917 | Clinical (unspecified phase) |
0.7209 | Intermediate Similarity | NPD7345 | Approved |
0.7051 | Intermediate Similarity | NPD2263 | Discontinued |
0.7037 | Intermediate Similarity | NPD6944 | Clinical (unspecified phase) |
0.6915 | Remote Similarity | NPD8394 | Approved |
0.6829 | Remote Similarity | NPD2256 | Clinical (unspecified phase) |
0.6778 | Remote Similarity | NPD619 | Phase 3 |
0.6706 | Remote Similarity | NPD2689 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD3724 | Clinical (unspecified phase) |
0.6598 | Remote Similarity | NPD4228 | Discovery |
0.6559 | Remote Similarity | NPD4264 | Clinical (unspecified phase) |
0.6538 | Remote Similarity | NPD8305 | Approved |
0.6538 | Remote Similarity | NPD8306 | Approved |
0.6437 | Remote Similarity | NPD3160 | Suspended |
0.6429 | Remote Similarity | NPD3187 | Discontinued |
0.6395 | Remote Similarity | NPD2257 | Approved |
0.6395 | Remote Similarity | NPD1453 | Phase 1 |
0.6346 | Remote Similarity | NPD1829 | Clinical (unspecified phase) |
0.6346 | Remote Similarity | NPD1828 | Approved |
0.6346 | Remote Similarity | NPD1827 | Clinical (unspecified phase) |
0.6333 | Remote Similarity | NPD1448 | Clinical (unspecified phase) |
0.6316 | Remote Similarity | NPD3716 | Discontinued |
0.6301 | Remote Similarity | NPD9441 | Phase 2 |
0.6296 | Remote Similarity | NPD8298 | Phase 2 |
0.6267 | Remote Similarity | NPD3729 | Clinical (unspecified phase) |
0.6238 | Remote Similarity | NPD8418 | Phase 2 |
0.6235 | Remote Similarity | NPD1147 | Phase 2 |
0.6203 | Remote Similarity | NPD574 | Approved |
0.619 | Remote Similarity | NPD8307 | Discontinued |
0.619 | Remote Similarity | NPD8140 | Approved |
0.6173 | Remote Similarity | NPD7909 | Approved |
0.6168 | Remote Similarity | NPD6421 | Discontinued |
0.6125 | Remote Similarity | NPD575 | Clinical (unspecified phase) |
0.6118 | Remote Similarity | NPD9446 | Approved |
0.6117 | Remote Similarity | NPD8139 | Approved |
0.6117 | Remote Similarity | NPD8085 | Approved |
0.6117 | Remote Similarity | NPD8086 | Approved |
0.6117 | Remote Similarity | NPD8084 | Approved |
0.6117 | Remote Similarity | NPD8138 | Approved |
0.6117 | Remote Similarity | NPD8082 | Approved |
0.6117 | Remote Similarity | NPD8083 | Approved |
0.6058 | Remote Similarity | NPD8276 | Approved |
0.6058 | Remote Similarity | NPD8275 | Approved |
0.6047 | Remote Similarity | NPD1825 | Clinical (unspecified phase) |
0.6042 | Remote Similarity | NPD618 | Clinical (unspecified phase) |
0.6024 | Remote Similarity | NPD1429 | Clinical (unspecified phase) |
0.602 | Remote Similarity | NPD6699 | Clinical (unspecified phase) |
0.6019 | Remote Similarity | NPD8087 | Discontinued |
0.6 | Remote Similarity | NPD7841 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD8081 | Approved |
0.5976 | Remote Similarity | NPD1831 | Phase 3 |
0.596 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.5946 | Remote Similarity | NPD7915 | Approved |
0.5946 | Remote Similarity | NPD7916 | Approved |
0.5943 | Remote Similarity | NPD8393 | Approved |
0.5926 | Remote Similarity | NPD6941 | Approved |
0.5918 | Remote Similarity | NPD4780 | Clinical (unspecified phase) |
0.5914 | Remote Similarity | NPD7643 | Phase 1 |
0.59 | Remote Similarity | NPD573 | Clinical (unspecified phase) |
0.5895 | Remote Similarity | NPD3723 | Clinical (unspecified phase) |
0.5895 | Remote Similarity | NPD7760 | Phase 2 |
0.5895 | Remote Similarity | NPD7759 | Phase 2 |
0.5882 | Remote Similarity | NPD4242 | Approved |
0.5875 | Remote Similarity | NPD3198 | Approved |
0.587 | Remote Similarity | NPD612 | Discontinued |
0.5833 | Remote Similarity | NPD9421 | Phase 1 |
0.5824 | Remote Similarity | NPD3732 | Approved |
0.5823 | Remote Similarity | NPD9433 | Approved |
0.5814 | Remote Similarity | NPD8277 | Approved |
0.5789 | Remote Similarity | NPD9204 | Approved |
0.5789 | Remote Similarity | NPD9205 | Approved |
0.5784 | Remote Similarity | NPD6428 | Approved |
0.5765 | Remote Similarity | NPD4241 | Registered |
0.5753 | Remote Similarity | NPD3211 | Approved |
0.5741 | Remote Similarity | NPD8175 | Discontinued |
0.5732 | Remote Similarity | NPD9676 | Phase 3 |
0.5728 | Remote Similarity | NPD8038 | Phase 2 |
0.5727 | Remote Similarity | NPD6420 | Discontinued |
0.5714 | Remote Similarity | NPD4278 | Clinical (unspecified phase) |
0.5698 | Remote Similarity | NPD8278 | Approved |
0.5684 | Remote Similarity | NPD3733 | Clinical (unspecified phase) |
0.566 | Remote Similarity | NPD7140 | Approved |
0.566 | Remote Similarity | NPD7141 | Clinical (unspecified phase) |
0.566 | Remote Similarity | NPD7139 | Approved |
0.5647 | Remote Similarity | NPD375 | Phase 2 |
0.5647 | Remote Similarity | NPD5380 | Approved |
0.5644 | Remote Similarity | NPD1447 | Phase 3 |
0.5644 | Remote Similarity | NPD1446 | Phase 3 |
0.5641 | Remote Similarity | NPD3730 | Approved |
0.5641 | Remote Similarity | NPD3728 | Approved |
0.5636 | Remote Similarity | NPD6413 | Approved |
0.5632 | Remote Similarity | NPD2696 | Approved |
0.5632 | Remote Similarity | NPD2694 | Approved |
0.5632 | Remote Similarity | NPD2697 | Approved |
0.5632 | Remote Similarity | NPD2695 | Approved |
0.5625 | Remote Similarity | NPD9661 | Approved |
0.5616 | Remote Similarity | NPD1152 | Phase 2 |
0.5612 | Remote Similarity | NPD4759 | Clinical (unspecified phase) |
0.561 | Remote Similarity | NPD9656 | Approved |
0.56 | Remote Similarity | NPD4261 | Phase 1 |
PubChem CID   | 5462499 |
ChEMBL   | CHEMBL3314611 |
ZINC   |
Molecular Weight:   | 671.45 |
ALogP:   | 1.1925 |
MLogP:   | 3.55 |
XLogP:   | 3.484 |
# Rotatable Bonds:   | 40 |
Polar Surface Area:   | 240.71 |
# H-Bond Aceptor:   | 14 |
# H-Bond Donor:   | 8 |
# Rings:   | 0 |
# Heavy Atoms:   | 47 |