Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT671 | Individual Protein | Acidic alpha-glucosidase | Rattus norvegicus | Inhibition | < | 50 | % | 18053715 |
NPT2 | Others | Unspecified | IC50 | = | 650000 | nM | PubChem BioAssay data set | |
NPT61 | Individual Protein | Beta-glucocerebrosidase | Homo sapiens | Inhibition | < | 50 | % | Open TG-GATES in vivo data: Biochemistry |
NPT2 | Others | Unspecified | Inhibition | < | 50 | % | 11170665 | |
NPT1131 | Individual Protein | Alpha-galactosidase | Coffea arabica | Inhibition | < | 50 | % | 12852747 |
NPT2 | Others | Unspecified | Inhibition | < | 50 | % | 16989528 | |
NPT2 | Others | Unspecified | IC50 | = | 11400 | nM | 22377672 | |
NPT506 | Individual Protein | Beta-mannosidase | Rattus norvegicus | Inhibition | < | 50 | % | 8691203 |
NPT496 | Individual Protein | Alpha-L-fucosidase 1 | Bos taurus | Inhibition | < | 50 | % | DrugMatrix in vitro pharmacology data |
NPT509 | Individual Protein | Beta-galactosidase | Bos taurus | IC50 | = | 920000 | nM | 23369536 |
NPT2 | Others | Unspecified | IC50 | = | 25400 | nM | Open TG-GATES in vivo data: Biochemistry | |
NPT2 | Others | Unspecified | IC50 | = | 390000 | nM | 19112026 | |
NPT2 | Others | Unspecified | Inhibition | < | 50 | % | 15921411 |
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 NPC474469 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 |
---|---|---|
0.9841 | High Similarity | NPC473419 |
0.9841 | High Similarity | NPC475715 |
0.9841 | High Similarity | NPC475127 |
0.9839 | High Similarity | NPC141156 |
0.9839 | High Similarity | NPC184150 |
0.9683 | High Similarity | NPC306763 |
0.9683 | High Similarity | NPC266242 |
0.9683 | High Similarity | NPC254617 |
0.9683 | High Similarity | NPC74555 |
0.9677 | High Similarity | NPC12514 |
0.9677 | High Similarity | NPC294883 |
0.9524 | High Similarity | NPC59221 |
0.9385 | High Similarity | NPC163538 |
0.9385 | High Similarity | NPC115800 |
0.8615 | High Similarity | NPC233034 |
0.8507 | High Similarity | NPC34291 |
0.8507 | High Similarity | NPC126664 |
0.8065 | Intermediate Similarity | NPC275727 |
0.8 | Intermediate Similarity | NPC473710 |
0.8 | Intermediate Similarity | NPC475694 |
0.7794 | Intermediate Similarity | NPC474928 |
0.7778 | Intermediate Similarity | NPC471442 |
0.7778 | Intermediate Similarity | NPC474468 |
0.7778 | Intermediate Similarity | NPC471423 |
0.7681 | Intermediate Similarity | NPC116377 |
0.7681 | Intermediate Similarity | NPC101746 |
0.7681 | Intermediate Similarity | NPC77191 |
0.7681 | Intermediate Similarity | NPC69798 |
0.7681 | Intermediate Similarity | NPC473952 |
0.7647 | Intermediate Similarity | NPC471419 |
0.7647 | Intermediate Similarity | NPC163134 |
0.7612 | Intermediate Similarity | NPC8087 |
0.7612 | Intermediate Similarity | NPC62507 |
0.7538 | Intermediate Similarity | NPC471443 |
0.7538 | Intermediate Similarity | NPC471605 |
0.7465 | Intermediate Similarity | NPC171850 |
0.7397 | Intermediate Similarity | NPC28959 |
0.7397 | Intermediate Similarity | NPC299603 |
0.7397 | Intermediate Similarity | NPC255535 |
0.7397 | Intermediate Similarity | NPC137554 |
0.7397 | Intermediate Similarity | NPC285014 |
0.7353 | Intermediate Similarity | NPC474014 |
0.7353 | Intermediate Similarity | NPC57846 |
0.7353 | Intermediate Similarity | NPC30126 |
0.7222 | Intermediate Similarity | NPC471418 |
0.7123 | Intermediate Similarity | NPC268922 |
0.7059 | Intermediate Similarity | NPC471421 |
0.7059 | Intermediate Similarity | NPC233364 |
0.7059 | Intermediate Similarity | NPC170172 |
0.7024 | Intermediate Similarity | NPC52533 |
0.7015 | Intermediate Similarity | NPC293551 |
0.7015 | Intermediate Similarity | NPC311668 |
0.7015 | Intermediate Similarity | NPC65832 |
0.7015 | Intermediate Similarity | NPC10262 |
0.6933 | Remote Similarity | NPC476696 |
0.6933 | Remote Similarity | NPC476695 |
0.6933 | Remote Similarity | NPC476694 |
0.6818 | Remote Similarity | NPC178263 |
0.6818 | Remote Similarity | NPC277072 |
0.6806 | Remote Similarity | NPC142290 |
0.6806 | Remote Similarity | NPC471892 |
0.6806 | Remote Similarity | NPC75435 |
0.6806 | Remote Similarity | NPC471780 |
0.6806 | Remote Similarity | NPC223386 |
0.6806 | Remote Similarity | NPC198341 |
0.6712 | Remote Similarity | NPC303798 |
0.6712 | Remote Similarity | NPC315980 |
0.6712 | Remote Similarity | NPC286851 |
0.6627 | Remote Similarity | NPC165119 |
0.6571 | Remote Similarity | NPC76726 |
0.6571 | Remote Similarity | NPC193593 |
0.6571 | Remote Similarity | NPC143809 |
0.6571 | Remote Similarity | NPC290106 |
0.6567 | Remote Similarity | NPC272396 |
0.6528 | Remote Similarity | NPC218150 |
0.6528 | Remote Similarity | NPC22774 |
0.6528 | Remote Similarity | NPC2432 |
0.6528 | Remote Similarity | NPC145627 |
0.6528 | Remote Similarity | NPC150680 |
0.6528 | Remote Similarity | NPC306462 |
0.6528 | Remote Similarity | NPC69669 |
0.6522 | Remote Similarity | NPC8979 |
0.642 | Remote Similarity | NPC233108 |
0.6413 | Remote Similarity | NPC313821 |
0.6341 | Remote Similarity | NPC150557 |
0.6329 | Remote Similarity | NPC315806 |
0.6322 | Remote Similarity | NPC306838 |
0.6301 | Remote Similarity | NPC17455 |
0.6265 | Remote Similarity | NPC100204 |
0.6265 | Remote Similarity | NPC83248 |
0.6197 | Remote Similarity | NPC204709 |
0.619 | Remote Similarity | NPC471420 |
0.6133 | Remote Similarity | NPC160661 |
0.6104 | Remote Similarity | NPC195165 |
0.6087 | Remote Similarity | NPC270041 |
0.6082 | Remote Similarity | NPC314387 |
0.6023 | Remote Similarity | NPC469363 |
0.5946 | Remote Similarity | NPC112398 |
0.5942 | Remote Similarity | NPC123814 |
0.593 | Remote Similarity | NPC271772 |
0.593 | Remote Similarity | NPC36927 |
0.5909 | Remote Similarity | NPC277918 |
0.5904 | Remote Similarity | NPC329077 |
0.59 | Remote Similarity | NPC471844 |
0.589 | Remote Similarity | NPC319991 |
0.5875 | Remote Similarity | NPC477200 |
0.5821 | Remote Similarity | NPC96966 |
0.5821 | Remote Similarity | NPC121062 |
0.5821 | Remote Similarity | NPC29222 |
0.5811 | Remote Similarity | NPC328786 |
0.5811 | Remote Similarity | NPC474627 |
0.5811 | Remote Similarity | NPC201338 |
0.5802 | Remote Similarity | NPC29326 |
0.5783 | Remote Similarity | NPC470782 |
0.5765 | Remote Similarity | NPC98750 |
0.575 | Remote Similarity | NPC327753 |
0.575 | Remote Similarity | NPC327486 |
0.575 | Remote Similarity | NPC223174 |
0.5747 | Remote Similarity | NPC81006 |
0.5732 | Remote Similarity | NPC126186 |
0.5714 | Remote Similarity | NPC474322 |
0.5698 | Remote Similarity | NPC70574 |
0.5698 | Remote Similarity | NPC90839 |
0.5696 | Remote Similarity | NPC316445 |
0.5679 | Remote Similarity | NPC306973 |
0.5652 | Remote Similarity | NPC275715 |
0.5652 | Remote Similarity | NPC322966 |
0.56 | Remote Similarity | NPC319131 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC474469 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 |
---|---|---|---|
0.9375 | High Similarity | NPD9444 | Discontinued |
0.8615 | High Similarity | NPD9440 | Discontinued |
0.8507 | High Similarity | NPD9443 | Clinical (unspecified phase) |
0.7463 | Intermediate Similarity | NPD9455 | Approved |
0.7353 | Intermediate Similarity | NPD393 | Approved |
0.725 | Intermediate Similarity | NPD883 | Phase 2 |
0.725 | Intermediate Similarity | NPD882 | Phase 2 |
0.6714 | Remote Similarity | NPD9239 | Approved |
0.6714 | Remote Similarity | NPD9240 | Approved |
0.6528 | Remote Similarity | NPD9026 | Phase 2 |
0.6528 | Remote Similarity | NPD9028 | Phase 2 |
0.6528 | Remote Similarity | NPD9027 | Phase 3 |
0.6528 | Remote Similarity | NPD9029 | Phase 3 |
0.6413 | Remote Similarity | NPD3191 | Approved |
0.6413 | Remote Similarity | NPD3189 | Approved |
0.6413 | Remote Similarity | NPD3190 | Approved |
0.6329 | Remote Similarity | NPD9653 | Clinical (unspecified phase) |
0.6207 | Remote Similarity | NPD394 | Phase 3 |
0.6133 | Remote Similarity | NPD1457 | Discontinued |
0.6098 | Remote Similarity | NPD372 | Clinical (unspecified phase) |
0.6082 | Remote Similarity | NPD3185 | Approved |
0.6082 | Remote Similarity | NPD3183 | Approved |
0.6082 | Remote Similarity | NPD3184 | Approved |
0.6082 | Remote Similarity | NPD3182 | Approved |
0.5946 | Remote Similarity | NPD9022 | Phase 2 |
0.5946 | Remote Similarity | NPD9024 | Phase 2 |
0.5942 | Remote Similarity | NPD3215 | Phase 1 |
0.593 | Remote Similarity | NPD2691 | Clinical (unspecified phase) |
0.5909 | Remote Similarity | NPD9401 | Discovery |
0.5783 | Remote Similarity | NPD9407 | Approved |
0.575 | Remote Similarity | NPD2220 | Clinical (unspecified phase) |
0.575 | Remote Similarity | NPD9445 | Approved |
0.5733 | Remote Similarity | NPD3193 | Approved |
0.5733 | Remote Similarity | NPD3192 | Approved |
0.5714 | Remote Similarity | NPD3177 | Phase 3 |
0.5679 | Remote Similarity | NPD9446 | Approved |
0.5673 | Remote Similarity | NPD3188 | Approved |
0.5667 | Remote Similarity | NPD3723 | Clinical (unspecified phase) |
0.5652 | Remote Similarity | NPD3214 | Discontinued |
0.561 | Remote Similarity | NPD3187 | Discontinued |
PubChem CID   | 11482798 |
ChEMBL   | CHEMBL469437 |
ZINC   |
Molecular Weight:   | 277.15 |
ALogP:   | -3.9422 |
MLogP:   | 2.01 |
XLogP:   | -2.42 |
# Rotatable Bonds:   | 11 |
Polar Surface Area:   | 124.62 |
# H-Bond Aceptor:   | 7 |
# H-Bond Donor:   | 6 |
# Rings:   | 2 |
# Heavy Atoms:   | 19 |