Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT602 | Organism | Mycobacterium smegmatis | Mycobacterium smegmatis | MIC | = | 180000 | nM | 10.6019/CHEMBL1201861 |
NPT1177 | Organism | Mycobacterium phlei | Mycobacterium phlei | MIC | = | 180000 | nM | DrugMatrix in vitro pharmacology data |
NPT4585 | Organism | Mycobacterium diernhoferi | Mycobacterium diernhoferi | MIC | = | 180000 | nM | 20112995 |
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 NPC473985 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 | NPC474298 |
1.0 | High Similarity | NPC475808 |
1.0 | High Similarity | NPC474299 |
1.0 | High Similarity | NPC28348 |
0.831 | Intermediate Similarity | NPC43219 |
0.8289 | Intermediate Similarity | NPC474312 |
0.8194 | Intermediate Similarity | NPC86064 |
0.7917 | Intermediate Similarity | NPC477643 |
0.7917 | Intermediate Similarity | NPC477641 |
0.7917 | Intermediate Similarity | NPC320865 |
0.7887 | Intermediate Similarity | NPC477642 |
0.7887 | Intermediate Similarity | NPC478256 |
0.7875 | Intermediate Similarity | NPC477728 |
0.7632 | Intermediate Similarity | NPC316242 |
0.7595 | Intermediate Similarity | NPC477730 |
0.7536 | Intermediate Similarity | NPC145658 |
0.7532 | Intermediate Similarity | NPC473984 |
0.7532 | Intermediate Similarity | NPC315535 |
0.7532 | Intermediate Similarity | NPC478017 |
0.7532 | Intermediate Similarity | NPC315131 |
0.75 | Intermediate Similarity | NPC155670 |
0.75 | Intermediate Similarity | NPC477644 |
0.75 | Intermediate Similarity | NPC95478 |
0.75 | Intermediate Similarity | NPC145748 |
0.7432 | Intermediate Similarity | NPC474403 |
0.7407 | Intermediate Similarity | NPC227051 |
0.7397 | Intermediate Similarity | NPC476291 |
0.7397 | Intermediate Similarity | NPC476285 |
0.7302 | Intermediate Similarity | NPC319110 |
0.7302 | Intermediate Similarity | NPC329181 |
0.7231 | Intermediate Similarity | NPC270041 |
0.7206 | Intermediate Similarity | NPC473599 |
0.72 | Intermediate Similarity | NPC141325 |
0.7176 | Intermediate Similarity | NPC477729 |
0.7143 | Intermediate Similarity | NPC476324 |
0.7143 | Intermediate Similarity | NPC476130 |
0.7105 | Intermediate Similarity | NPC138435 |
0.7027 | Intermediate Similarity | NPC314273 |
0.7027 | Intermediate Similarity | NPC474812 |
0.7027 | Intermediate Similarity | NPC193280 |
0.7011 | Intermediate Similarity | NPC270005 |
0.7011 | Intermediate Similarity | NPC208537 |
0.6951 | Remote Similarity | NPC47135 |
0.6901 | Remote Similarity | NPC145627 |
0.6892 | Remote Similarity | NPC470110 |
0.6883 | Remote Similarity | NPC476248 |
0.6825 | Remote Similarity | NPC319709 |
0.6825 | Remote Similarity | NPC289484 |
0.6795 | Remote Similarity | NPC472595 |
0.6757 | Remote Similarity | NPC470109 |
0.6667 | Remote Similarity | NPC474833 |
0.6625 | Remote Similarity | NPC472594 |
0.6622 | Remote Similarity | NPC326651 |
0.6622 | Remote Similarity | NPC325117 |
0.6622 | Remote Similarity | NPC322319 |
0.6622 | Remote Similarity | NPC474402 |
0.6622 | Remote Similarity | NPC470108 |
0.6579 | Remote Similarity | NPC472579 |
0.6567 | Remote Similarity | NPC329495 |
0.6506 | Remote Similarity | NPC314466 |
0.6447 | Remote Similarity | NPC195165 |
0.6404 | Remote Similarity | NPC39290 |
0.6404 | Remote Similarity | NPC159369 |
0.6383 | Remote Similarity | NPC220234 |
0.6292 | Remote Similarity | NPC292345 |
0.6292 | Remote Similarity | NPC193386 |
0.6269 | Remote Similarity | NPC90904 |
0.625 | Remote Similarity | NPC254541 |
0.6207 | Remote Similarity | NPC476523 |
0.6203 | Remote Similarity | NPC169976 |
0.6203 | Remote Similarity | NPC126366 |
0.6203 | Remote Similarity | NPC33267 |
0.6203 | Remote Similarity | NPC477200 |
0.6203 | Remote Similarity | NPC170963 |
0.6203 | Remote Similarity | NPC114640 |
0.6203 | Remote Similarity | NPC324165 |
0.62 | Remote Similarity | NPC67009 |
0.6162 | Remote Similarity | NPC475918 |
0.6143 | Remote Similarity | NPC471917 |
0.6143 | Remote Similarity | NPC320588 |
0.6143 | Remote Similarity | NPC53463 |
0.6143 | Remote Similarity | NPC469937 |
0.6143 | Remote Similarity | NPC23155 |
0.6133 | Remote Similarity | NPC316674 |
0.6129 | Remote Similarity | NPC470283 |
0.6125 | Remote Similarity | NPC55274 |
0.6111 | Remote Similarity | NPC176164 |
0.6111 | Remote Similarity | NPC472578 |
0.6111 | Remote Similarity | NPC189301 |
0.6087 | Remote Similarity | NPC123814 |
0.6087 | Remote Similarity | NPC315237 |
0.6087 | Remote Similarity | NPC474322 |
0.6076 | Remote Similarity | NPC291196 |
0.6076 | Remote Similarity | NPC103712 |
0.6061 | Remote Similarity | NPC74035 |
0.6047 | Remote Similarity | NPC246005 |
0.6032 | Remote Similarity | NPC241279 |
0.6027 | Remote Similarity | NPC320598 |
0.6022 | Remote Similarity | NPC226513 |
0.602 | Remote Similarity | NPC301148 |
0.602 | Remote Similarity | NPC124554 |
0.602 | Remote Similarity | NPC5864 |
0.6 | Remote Similarity | NPC327252 |
0.6 | Remote Similarity | NPC17455 |
0.5976 | Remote Similarity | NPC288086 |
0.597 | Remote Similarity | NPC131770 |
0.597 | Remote Similarity | NPC200618 |
0.597 | Remote Similarity | NPC106872 |
0.596 | Remote Similarity | NPC198344 |
0.5952 | Remote Similarity | NPC37681 |
0.5949 | Remote Similarity | NPC224700 |
0.5949 | Remote Similarity | NPC320663 |
0.5946 | Remote Similarity | NPC471129 |
0.5926 | Remote Similarity | NPC54460 |
0.5918 | Remote Similarity | NPC188453 |
0.5918 | Remote Similarity | NPC42320 |
0.5915 | Remote Similarity | NPC289979 |
0.5915 | Remote Similarity | NPC322573 |
0.5909 | Remote Similarity | NPC320936 |
0.5909 | Remote Similarity | NPC323180 |
0.5904 | Remote Similarity | NPC217095 |
0.5904 | Remote Similarity | NPC264417 |
0.59 | Remote Similarity | NPC124549 |
0.5897 | Remote Similarity | NPC118524 |
0.589 | Remote Similarity | NPC328447 |
0.5882 | Remote Similarity | NPC316807 |
0.5882 | Remote Similarity | NPC270805 |
0.5882 | Remote Similarity | NPC93888 |
0.5875 | Remote Similarity | NPC280065 |
0.5875 | Remote Similarity | NPC45060 |
0.5865 | Remote Similarity | NPC476875 |
0.5844 | Remote Similarity | NPC314103 |
0.5843 | Remote Similarity | NPC175419 |
0.5843 | Remote Similarity | NPC125253 |
0.5843 | Remote Similarity | NPC192025 |
0.5843 | Remote Similarity | NPC253975 |
0.5821 | Remote Similarity | NPC181588 |
0.5821 | Remote Similarity | NPC328497 |
0.5821 | Remote Similarity | NPC324004 |
0.5816 | Remote Similarity | NPC233932 |
0.5811 | Remote Similarity | NPC316826 |
0.5811 | Remote Similarity | NPC317143 |
0.5811 | Remote Similarity | NPC321536 |
0.5811 | Remote Similarity | NPC321468 |
0.5811 | Remote Similarity | NPC327748 |
0.5806 | Remote Similarity | NPC139782 |
0.5806 | Remote Similarity | NPC74672 |
0.5806 | Remote Similarity | NPC209047 |
0.5806 | Remote Similarity | NPC43074 |
0.5806 | Remote Similarity | NPC242503 |
0.5797 | Remote Similarity | NPC327239 |
0.5789 | Remote Similarity | NPC470665 |
0.5775 | Remote Similarity | NPC316889 |
0.5775 | Remote Similarity | NPC321118 |
0.5761 | Remote Similarity | NPC322966 |
0.5761 | Remote Similarity | NPC470284 |
0.5753 | Remote Similarity | NPC318260 |
0.5753 | Remote Similarity | NPC317147 |
0.5753 | Remote Similarity | NPC8979 |
0.575 | Remote Similarity | NPC126779 |
0.5745 | Remote Similarity | NPC263545 |
0.5745 | Remote Similarity | NPC111567 |
0.5745 | Remote Similarity | NPC473950 |
0.5745 | Remote Similarity | NPC15851 |
0.5745 | Remote Similarity | NPC309898 |
0.5745 | Remote Similarity | NPC475603 |
0.5745 | Remote Similarity | NPC473581 |
0.5745 | Remote Similarity | NPC186840 |
0.5745 | Remote Similarity | NPC475125 |
0.5745 | Remote Similarity | NPC61894 |
0.5745 | Remote Similarity | NPC473604 |
0.5733 | Remote Similarity | NPC201338 |
0.5733 | Remote Similarity | NPC328786 |
0.5733 | Remote Similarity | NPC329003 |
0.5733 | Remote Similarity | NPC474627 |
0.5733 | Remote Similarity | NPC319131 |
0.5733 | Remote Similarity | NPC143722 |
0.5733 | Remote Similarity | NPC17935 |
0.5733 | Remote Similarity | NPC329564 |
0.5733 | Remote Similarity | NPC325550 |
0.5733 | Remote Similarity | NPC470363 |
0.5733 | Remote Similarity | NPC326524 |
0.5733 | Remote Similarity | NPC327170 |
0.5728 | Remote Similarity | NPC171734 |
0.5714 | Remote Similarity | NPC119633 |
0.5714 | Remote Similarity | NPC322946 |
0.5714 | Remote Similarity | NPC321340 |
0.5714 | Remote Similarity | NPC171698 |
0.5714 | Remote Similarity | NPC270957 |
0.5699 | Remote Similarity | NPC474593 |
0.5699 | Remote Similarity | NPC475801 |
0.5682 | Remote Similarity | NPC82799 |
0.5679 | Remote Similarity | NPC223174 |
0.5679 | Remote Similarity | NPC327753 |
0.5679 | Remote Similarity | NPC327486 |
0.5673 | Remote Similarity | NPC329305 |
0.5672 | Remote Similarity | NPC12438 |
0.5672 | Remote Similarity | NPC30195 |
0.5672 | Remote Similarity | NPC297220 |
0.567 | Remote Similarity | NPC134504 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC473985 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 |
---|---|---|---|
0.7917 | Intermediate Similarity | NPD2256 | Clinical (unspecified phase) |
0.7532 | Intermediate Similarity | NPD7918 | Clinical (unspecified phase) |
0.7532 | Intermediate Similarity | NPD7917 | Clinical (unspecified phase) |
0.726 | Intermediate Similarity | NPD3724 | Clinical (unspecified phase) |
0.7241 | Intermediate Similarity | NPD8394 | Approved |
0.6986 | Remote Similarity | NPD2263 | Discontinued |
0.6962 | Remote Similarity | NPD3160 | Suspended |
0.6951 | Remote Similarity | NPD7345 | Approved |
0.6825 | Remote Similarity | NPD3211 | Approved |
0.6753 | Remote Similarity | NPD6944 | Clinical (unspecified phase) |
0.6667 | Remote Similarity | NPD1152 | Phase 2 |
0.6625 | Remote Similarity | NPD2689 | Clinical (unspecified phase) |
0.65 | Remote Similarity | NPD1453 | Phase 1 |
0.6471 | Remote Similarity | NPD9419 | Clinical (unspecified phase) |
0.6404 | Remote Similarity | NPD3716 | Discontinued |
0.6329 | Remote Similarity | NPD3187 | Discontinued |
0.6322 | Remote Similarity | NPD619 | Phase 3 |
0.6316 | Remote Similarity | NPD5380 | Approved |
0.6292 | Remote Similarity | NPD618 | Clinical (unspecified phase) |
0.6216 | Remote Similarity | NPD4283 | Discontinued |
0.617 | Remote Similarity | NPD6428 | Approved |
0.6154 | Remote Similarity | NPD1815 | Discontinued |
0.6143 | Remote Similarity | NPD3728 | Approved |
0.6143 | Remote Similarity | NPD3730 | Approved |
0.6139 | Remote Similarity | NPD6941 | Approved |
0.6133 | Remote Similarity | NPD364 | Discontinued |
0.6098 | Remote Similarity | NPD376 | Approved |
0.6098 | Remote Similarity | NPD11 | Approved |
0.6087 | Remote Similarity | NPD3215 | Phase 1 |
0.6081 | Remote Similarity | NPD574 | Approved |
0.6076 | Remote Similarity | NPD8277 | Approved |
0.6064 | Remote Similarity | NPD7844 | Discontinued |
0.6056 | Remote Similarity | NPD9659 | Approved |
0.6047 | Remote Similarity | NPD1448 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD575 | Clinical (unspecified phase) |
0.6 | Remote Similarity | NPD9446 | Approved |
0.6 | Remote Similarity | NPD4759 | Clinical (unspecified phase) |
0.5978 | Remote Similarity | NPD4780 | Clinical (unspecified phase) |
0.5949 | Remote Similarity | NPD8278 | Approved |
0.5934 | Remote Similarity | NPD4264 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD1151 | Approved |
0.5915 | Remote Similarity | NPD4277 | Approved |
0.5915 | Remote Similarity | NPD4276 | Approved |
0.589 | Remote Similarity | NPD9661 | Approved |
0.589 | Remote Similarity | NPD9433 | Approved |
0.5882 | Remote Similarity | NPD8624 | Approved |
0.5859 | Remote Similarity | NPD7141 | Clinical (unspecified phase) |
0.5859 | Remote Similarity | NPD7139 | Approved |
0.5859 | Remote Similarity | NPD7140 | Approved |
0.5851 | Remote Similarity | NPD1447 | Phase 3 |
0.5851 | Remote Similarity | NPD1446 | Phase 3 |
0.5844 | Remote Similarity | NPD1831 | Phase 3 |
0.5833 | Remote Similarity | NPD4228 | Discovery |
0.5825 | Remote Similarity | NPD6413 | Approved |
0.5825 | Remote Similarity | NPD8305 | Approved |
0.5825 | Remote Similarity | NPD8306 | Approved |
0.5821 | Remote Similarity | NPD8810 | Clinical (unspecified phase) |
0.5806 | Remote Similarity | NPD8522 | Clinical (unspecified phase) |
0.58 | Remote Similarity | NPD8045 | Clinical (unspecified phase) |
0.5797 | Remote Similarity | NPD3214 | Discontinued |
0.5797 | Remote Similarity | NPD329 | Discontinued |
0.5795 | Remote Similarity | NPD883 | Phase 2 |
0.5795 | Remote Similarity | NPD882 | Phase 2 |
0.575 | Remote Similarity | NPD4242 | Approved |
0.5732 | Remote Similarity | NPD6704 | Discontinued |
0.5714 | Remote Similarity | NPD2255 | Approved |
0.5714 | Remote Similarity | NPD9441 | Phase 2 |
0.5696 | Remote Similarity | NPD1429 | Clinical (unspecified phase) |
0.5684 | Remote Similarity | NPD5781 | Clinical (unspecified phase) |
0.5679 | Remote Similarity | NPD9445 | Approved |
0.5658 | Remote Similarity | NPD3193 | Approved |
0.5658 | Remote Similarity | NPD3192 | Approved |
0.5634 | Remote Similarity | NPD9204 | Approved |
0.5634 | Remote Similarity | NPD9205 | Approved |
0.5634 | Remote Similarity | NPD9660 | Approved |
0.5625 | Remote Similarity | NPD4241 | Registered |
0.5619 | Remote Similarity | NPD6421 | Discontinued |
0.561 | Remote Similarity | NPD2262 | Clinical (unspecified phase) |
0.5604 | Remote Similarity | NPD3723 | Clinical (unspecified phase) |
PubChem CID   | 24862375 |
ChEMBL   | CHEMBL457267 |
ZINC   |
Molecular Weight:   | 500.31 |
ALogP:   | -4.6536 |
MLogP:   | 3.11 |
XLogP:   | 4.829 |
# Rotatable Bonds:   | 19 |
Polar Surface Area:   | 158.24 |
# H-Bond Aceptor:   | 10 |
# H-Bond Donor:   | 4 |
# Rings:   | 1 |
# Heavy Atoms:   | 35 |