Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT179 | Cell Line | A2780 | Homo sapiens | IC50 | = | 2.4 | ug/ml | 16499334 |
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 NPC11130 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 |
---|---|---|
0.8947 | High Similarity | NPC309825 |
0.8679 | High Similarity | NPC26960 |
0.8679 | High Similarity | NPC182102 |
0.8548 | High Similarity | NPC68703 |
0.8548 | High Similarity | NPC69649 |
0.8475 | Intermediate Similarity | NPC176621 |
0.8421 | Intermediate Similarity | NPC249645 |
0.8421 | Intermediate Similarity | NPC55412 |
0.8254 | Intermediate Similarity | NPC114651 |
0.8167 | Intermediate Similarity | NPC234264 |
0.8167 | Intermediate Similarity | NPC47840 |
0.8154 | Intermediate Similarity | NPC189745 |
0.8154 | Intermediate Similarity | NPC34834 |
0.8033 | Intermediate Similarity | NPC469728 |
0.7969 | Intermediate Similarity | NPC171225 |
0.7937 | Intermediate Similarity | NPC107258 |
0.791 | Intermediate Similarity | NPC474743 |
0.7903 | Intermediate Similarity | NPC124112 |
0.7869 | Intermediate Similarity | NPC471081 |
0.7857 | Intermediate Similarity | NPC244038 |
0.7812 | Intermediate Similarity | NPC149680 |
0.7812 | Intermediate Similarity | NPC250977 |
0.7812 | Intermediate Similarity | NPC259156 |
0.7812 | Intermediate Similarity | NPC286669 |
0.7812 | Intermediate Similarity | NPC222366 |
0.7812 | Intermediate Similarity | NPC242945 |
0.7812 | Intermediate Similarity | NPC476039 |
0.7794 | Intermediate Similarity | NPC306727 |
0.7794 | Intermediate Similarity | NPC201048 |
0.7794 | Intermediate Similarity | NPC476366 |
0.7778 | Intermediate Similarity | NPC225415 |
0.7778 | Intermediate Similarity | NPC290367 |
0.7778 | Intermediate Similarity | NPC107540 |
0.7778 | Intermediate Similarity | NPC475704 |
0.7778 | Intermediate Similarity | NPC329698 |
0.7727 | Intermediate Similarity | NPC474248 |
0.7692 | Intermediate Similarity | NPC197805 |
0.7681 | Intermediate Similarity | NPC32832 |
0.7656 | Intermediate Similarity | NPC163678 |
0.7656 | Intermediate Similarity | NPC19569 |
0.7636 | Intermediate Similarity | NPC124851 |
0.7627 | Intermediate Similarity | NPC298299 |
0.7576 | Intermediate Similarity | NPC471238 |
0.7576 | Intermediate Similarity | NPC160209 |
0.7576 | Intermediate Similarity | NPC216460 |
0.7576 | Intermediate Similarity | NPC96484 |
0.7576 | Intermediate Similarity | NPC208999 |
0.7571 | Intermediate Similarity | NPC470749 |
0.7571 | Intermediate Similarity | NPC244488 |
0.7571 | Intermediate Similarity | NPC247325 |
0.7541 | Intermediate Similarity | NPC181872 |
0.7538 | Intermediate Similarity | NPC202017 |
0.7538 | Intermediate Similarity | NPC476406 |
0.7538 | Intermediate Similarity | NPC135650 |
0.7538 | Intermediate Similarity | NPC279434 |
0.75 | Intermediate Similarity | NPC474643 |
0.75 | Intermediate Similarity | NPC477792 |
0.75 | Intermediate Similarity | NPC309300 |
0.75 | Intermediate Similarity | NPC22765 |
0.75 | Intermediate Similarity | NPC96793 |
0.75 | Intermediate Similarity | NPC17518 |
0.75 | Intermediate Similarity | NPC48891 |
0.75 | Intermediate Similarity | NPC473865 |
0.75 | Intermediate Similarity | NPC323424 |
0.7465 | Intermediate Similarity | NPC470711 |
0.7465 | Intermediate Similarity | NPC91594 |
0.7465 | Intermediate Similarity | NPC470758 |
0.7463 | Intermediate Similarity | NPC473893 |
0.7463 | Intermediate Similarity | NPC471560 |
0.7429 | Intermediate Similarity | NPC313179 |
0.7429 | Intermediate Similarity | NPC69383 |
0.7429 | Intermediate Similarity | NPC171148 |
0.7419 | Intermediate Similarity | NPC475931 |
0.7419 | Intermediate Similarity | NPC122239 |
0.7361 | Intermediate Similarity | NPC297996 |
0.7361 | Intermediate Similarity | NPC239098 |
0.7361 | Intermediate Similarity | NPC167891 |
0.7361 | Intermediate Similarity | NPC476314 |
0.7361 | Intermediate Similarity | NPC83351 |
0.7353 | Intermediate Similarity | NPC145498 |
0.7344 | Intermediate Similarity | NPC474155 |
0.7344 | Intermediate Similarity | NPC81615 |
0.7344 | Intermediate Similarity | NPC473759 |
0.7344 | Intermediate Similarity | NPC283247 |
0.7333 | Intermediate Similarity | NPC474644 |
0.7333 | Intermediate Similarity | NPC329686 |
0.7324 | Intermediate Similarity | NPC265588 |
0.7324 | Intermediate Similarity | NPC253190 |
0.7313 | Intermediate Similarity | NPC32055 |
0.7313 | Intermediate Similarity | NPC476945 |
0.7302 | Intermediate Similarity | NPC240506 |
0.7286 | Intermediate Similarity | NPC469533 |
0.7286 | Intermediate Similarity | NPC469534 |
0.7286 | Intermediate Similarity | NPC469593 |
0.7273 | Intermediate Similarity | NPC185587 |
0.7273 | Intermediate Similarity | NPC86683 |
0.726 | Intermediate Similarity | NPC28862 |
0.726 | Intermediate Similarity | NPC109546 |
0.726 | Intermediate Similarity | NPC84694 |
0.726 | Intermediate Similarity | NPC209430 |
0.726 | Intermediate Similarity | NPC242767 |
0.726 | Intermediate Similarity | NPC81306 |
0.726 | Intermediate Similarity | NPC30986 |
0.726 | Intermediate Similarity | NPC143182 |
0.726 | Intermediate Similarity | NPC47982 |
0.7246 | Intermediate Similarity | NPC471272 |
0.7246 | Intermediate Similarity | NPC471271 |
0.7246 | Intermediate Similarity | NPC471268 |
0.7246 | Intermediate Similarity | NPC167706 |
0.7246 | Intermediate Similarity | NPC242001 |
0.7206 | Intermediate Similarity | NPC9942 |
0.7206 | Intermediate Similarity | NPC269877 |
0.7206 | Intermediate Similarity | NPC167272 |
0.7188 | Intermediate Similarity | NPC41160 |
0.7188 | Intermediate Similarity | NPC210346 |
0.7188 | Intermediate Similarity | NPC475251 |
0.717 | Intermediate Similarity | NPC269823 |
0.7162 | Intermediate Similarity | NPC306095 |
0.7162 | Intermediate Similarity | NPC281880 |
0.7162 | Intermediate Similarity | NPC234193 |
0.7162 | Intermediate Similarity | NPC96362 |
0.7162 | Intermediate Similarity | NPC295131 |
0.7143 | Intermediate Similarity | NPC471799 |
0.7143 | Intermediate Similarity | NPC130665 |
0.7143 | Intermediate Similarity | NPC474140 |
0.7143 | Intermediate Similarity | NPC182717 |
0.7143 | Intermediate Similarity | NPC68443 |
0.7123 | Intermediate Similarity | NPC474216 |
0.7123 | Intermediate Similarity | NPC11908 |
0.7121 | Intermediate Similarity | NPC187619 |
0.7101 | Intermediate Similarity | NPC49422 |
0.7101 | Intermediate Similarity | NPC9161 |
0.7083 | Intermediate Similarity | NPC19907 |
0.7077 | Intermediate Similarity | NPC174956 |
0.7067 | Intermediate Similarity | NPC209620 |
0.7067 | Intermediate Similarity | NPC4166 |
0.7067 | Intermediate Similarity | NPC159148 |
0.7067 | Intermediate Similarity | NPC249423 |
0.7067 | Intermediate Similarity | NPC23852 |
0.7067 | Intermediate Similarity | NPC476646 |
0.7067 | Intermediate Similarity | NPC264245 |
0.7059 | Intermediate Similarity | NPC117804 |
0.7049 | Intermediate Similarity | NPC251666 |
0.7049 | Intermediate Similarity | NPC148163 |
0.7049 | Intermediate Similarity | NPC148216 |
0.7049 | Intermediate Similarity | NPC130209 |
0.7049 | Intermediate Similarity | NPC232247 |
0.7042 | Intermediate Similarity | NPC91858 |
0.7042 | Intermediate Similarity | NPC477138 |
0.7042 | Intermediate Similarity | NPC243342 |
0.7042 | Intermediate Similarity | NPC471797 |
0.7042 | Intermediate Similarity | NPC78527 |
0.7042 | Intermediate Similarity | NPC100334 |
0.7037 | Intermediate Similarity | NPC256766 |
0.7037 | Intermediate Similarity | NPC213538 |
0.7031 | Intermediate Similarity | NPC66020 |
0.7015 | Intermediate Similarity | NPC162309 |
0.7 | Intermediate Similarity | NPC471662 |
0.7 | Intermediate Similarity | NPC95863 |
0.7 | Intermediate Similarity | NPC110799 |
0.7 | Intermediate Similarity | NPC133253 |
0.7 | Intermediate Similarity | NPC23954 |
0.6986 | Remote Similarity | NPC74995 |
0.6984 | Remote Similarity | NPC226848 |
0.6984 | Remote Similarity | NPC60772 |
0.6984 | Remote Similarity | NPC155025 |
0.6974 | Remote Similarity | NPC311092 |
0.6974 | Remote Similarity | NPC202389 |
0.6974 | Remote Similarity | NPC155521 |
0.6974 | Remote Similarity | NPC296701 |
0.6974 | Remote Similarity | NPC218616 |
0.6974 | Remote Similarity | NPC2524 |
0.6974 | Remote Similarity | NPC101462 |
0.6974 | Remote Similarity | NPC49964 |
0.6974 | Remote Similarity | NPC189972 |
0.6974 | Remote Similarity | NPC50964 |
0.6974 | Remote Similarity | NPC87489 |
0.697 | Remote Similarity | NPC52449 |
0.697 | Remote Similarity | NPC169275 |
0.697 | Remote Similarity | NPC68656 |
0.6949 | Remote Similarity | NPC474495 |
0.6949 | Remote Similarity | NPC473672 |
0.6944 | Remote Similarity | NPC304309 |
0.6944 | Remote Similarity | NPC477923 |
0.6944 | Remote Similarity | NPC471723 |
0.6944 | Remote Similarity | NPC288035 |
0.6944 | Remote Similarity | NPC136188 |
0.6944 | Remote Similarity | NPC134847 |
0.6944 | Remote Similarity | NPC133580 |
0.6944 | Remote Similarity | NPC22105 |
0.6944 | Remote Similarity | NPC291503 |
0.6944 | Remote Similarity | NPC66566 |
0.6944 | Remote Similarity | NPC257347 |
0.6944 | Remote Similarity | NPC162742 |
0.6944 | Remote Similarity | NPC285893 |
0.6944 | Remote Similarity | NPC28657 |
0.6944 | Remote Similarity | NPC471468 |
0.6944 | Remote Similarity | NPC141071 |
0.6944 | Remote Similarity | NPC230301 |
0.6933 | Remote Similarity | NPC209944 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC11130 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 |
---|---|---|---|
0.8421 | Intermediate Similarity | NPD4219 | Approved |
0.7429 | Intermediate Similarity | NPD8264 | Approved |
0.7206 | Intermediate Similarity | NPD6922 | Approved |
0.7206 | Intermediate Similarity | NPD6923 | Approved |
0.7123 | Intermediate Similarity | NPD7322 | Clinical (unspecified phase) |
0.7101 | Intermediate Similarity | NPD7143 | Approved |
0.7101 | Intermediate Similarity | NPD7144 | Approved |
0.7049 | Intermediate Similarity | NPD342 | Phase 1 |
0.7 | Intermediate Similarity | NPD7150 | Approved |
0.7 | Intermediate Similarity | NPD7152 | Approved |
0.7 | Intermediate Similarity | NPD7151 | Approved |
0.6986 | Remote Similarity | NPD5776 | Phase 2 |
0.6986 | Remote Similarity | NPD6925 | Approved |
0.6944 | Remote Similarity | NPD6942 | Approved |
0.6944 | Remote Similarity | NPD7339 | Approved |
0.6933 | Remote Similarity | NPD7332 | Phase 2 |
0.6933 | Remote Similarity | NPD7514 | Phase 3 |
0.6923 | Remote Similarity | NPD4191 | Approved |
0.6923 | Remote Similarity | NPD368 | Approved |
0.6923 | Remote Similarity | NPD4192 | Approved |
0.6923 | Remote Similarity | NPD4193 | Approved |
0.6923 | Remote Similarity | NPD4194 | Approved |
0.6892 | Remote Similarity | NPD7145 | Approved |
0.6842 | Remote Similarity | NPD6902 | Approved |
0.6806 | Remote Similarity | NPD6926 | Approved |
0.6806 | Remote Similarity | NPD6924 | Approved |
0.68 | Remote Similarity | NPD6929 | Approved |
0.6727 | Remote Similarity | NPD1799 | Clinical (unspecified phase) |
0.6716 | Remote Similarity | NPD5325 | Clinical (unspecified phase) |
0.6711 | Remote Similarity | NPD6930 | Phase 2 |
0.6711 | Remote Similarity | NPD6931 | Approved |
0.6667 | Remote Similarity | NPD4265 | Approved |
0.6623 | Remote Similarity | NPD6898 | Phase 1 |
0.6622 | Remote Similarity | NPD3701 | Clinical (unspecified phase) |
0.6622 | Remote Similarity | NPD6933 | Approved |
0.6579 | Remote Similarity | NPD7645 | Phase 2 |
0.6533 | Remote Similarity | NPD6932 | Approved |
0.6528 | Remote Similarity | NPD4243 | Approved |
0.6494 | Remote Similarity | NPD7525 | Registered |
0.6456 | Remote Similarity | NPD6695 | Phase 3 |
0.6375 | Remote Similarity | NPD7338 | Clinical (unspecified phase) |
0.6364 | Remote Similarity | NPD6683 | Phase 2 |
0.6351 | Remote Similarity | NPD4784 | Approved |
0.6351 | Remote Similarity | NPD4785 | Approved |
0.6341 | Remote Similarity | NPD4751 | Clinical (unspecified phase) |
0.6333 | Remote Similarity | NPD8262 | Approved |
0.6296 | Remote Similarity | NPD6893 | Approved |
0.6282 | Remote Similarity | NPD7509 | Discontinued |
0.6234 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.6216 | Remote Similarity | NPD4732 | Discontinued |
0.6173 | Remote Similarity | NPD4786 | Approved |
0.6145 | Remote Similarity | NPD7750 | Discontinued |
0.6145 | Remote Similarity | NPD7524 | Approved |
0.6125 | Remote Similarity | NPD3667 | Approved |
0.6111 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6053 | Remote Similarity | NPD4190 | Phase 3 |
0.6053 | Remote Similarity | NPD5275 | Approved |
0.6047 | Remote Similarity | NPD7637 | Suspended |
0.6027 | Remote Similarity | NPD4137 | Phase 3 |
0.5976 | Remote Similarity | NPD6400 | Clinical (unspecified phase) |
0.5976 | Remote Similarity | NPD3665 | Phase 1 |
0.5976 | Remote Similarity | NPD3666 | Approved |
0.5976 | Remote Similarity | NPD3133 | Approved |
0.597 | Remote Similarity | NPD287 | Approved |
0.5946 | Remote Similarity | NPD4691 | Approved |
0.5946 | Remote Similarity | NPD4747 | Approved |
0.5946 | Remote Similarity | NPD6939 | Phase 2 |
0.5946 | Remote Similarity | NPD6938 | Clinical (unspecified phase) |
0.593 | Remote Similarity | NPD7136 | Phase 2 |
0.5926 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5921 | Remote Similarity | NPD5733 | Approved |
0.5867 | Remote Similarity | NPD5276 | Approved |
0.5862 | Remote Similarity | NPD7087 | Discontinued |
0.5844 | Remote Similarity | NPD8039 | Approved |
0.5833 | Remote Similarity | NPD4519 | Discontinued |
0.5833 | Remote Similarity | NPD3618 | Phase 1 |
0.5833 | Remote Similarity | NPD5279 | Phase 3 |
0.5833 | Remote Similarity | NPD4623 | Approved |
0.5818 | Remote Similarity | NPD319 | Phase 1 |
0.5814 | Remote Similarity | NPD5328 | Approved |
0.5761 | Remote Similarity | NPD7640 | Approved |
0.5761 | Remote Similarity | NPD7639 | Approved |
0.575 | Remote Similarity | NPD4195 | Approved |
0.5714 | Remote Similarity | NPD5734 | Clinical (unspecified phase) |
0.5714 | Remote Similarity | NPD4058 | Approved |
0.5714 | Remote Similarity | NPD4687 | Approved |
0.5714 | Remote Similarity | NPD1696 | Phase 3 |
0.5682 | Remote Similarity | NPD6079 | Approved |
0.5682 | Remote Similarity | NPD7515 | Phase 2 |
0.5679 | Remote Similarity | NPD4695 | Discontinued |
0.5679 | Remote Similarity | NPD4821 | Approved |
0.5679 | Remote Similarity | NPD4820 | Approved |
0.5679 | Remote Similarity | NPD4822 | Approved |
0.5679 | Remote Similarity | NPD4748 | Discontinued |
0.5679 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.5679 | Remote Similarity | NPD4819 | Approved |
0.5663 | Remote Similarity | NPD5331 | Approved |
0.5663 | Remote Similarity | NPD5332 | Approved |
0.5663 | Remote Similarity | NPD5362 | Discontinued |
0.5652 | Remote Similarity | NPD7638 | Approved |
0.5652 | Remote Similarity | NPD4225 | Approved |
0.5632 | Remote Similarity | NPD6051 | Approved |
0.5632 | Remote Similarity | NPD4753 | Phase 2 |
0.5625 | Remote Similarity | NPD4271 | Approved |
0.5625 | Remote Similarity | NPD4268 | Approved |
0.561 | Remote Similarity | NPD4790 | Discontinued |
PubChem CID   | 11500301 |
ChEMBL   | CHEMBL482226 |
ZINC   |
Molecular Weight:   | 294.29 |
ALogP:   | 2.1834 |
MLogP:   | 3.55 |
XLogP:   | 8.585 |
# Rotatable Bonds:   | 14 |
Polar Surface Area:   | 20.23 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 1 |
# Rings:   | 1 |
# Heavy Atoms:   | 21 |