Natural Product: NPC126481

Natural Product ID:  NPC126481
Common Name:   Lycoparin C
IUPAC Name:  
Synonyms:   Lycoparin C
Molecular Formula:   C15H18N2O2
Standard InCHIKey:  KKOQTAOXNQUZKU-FIXISWKDSA-N
Standard InCHI:  InChI=1S/C15H18N2O2/c1-2-11-10-5-9(8-18)7-15(11,16)12-3-4-14(19)17-13(12)6-10/h2-5,10-11,18H,1,6-8,16H2,(H,17,19)/t10-,11+,15+/m0/s1
Canonical SMILES:  C=C[C@@H]1[C@H]2C=C(C[C@]1(N)c1c(C2)nc(cc1)O)CO
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO17043 Lycopodium casuarinoides Species Lycopodiaceae Eukaryota PMID[18485717]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT914 Individual Protein Acetylcholinesterase Bos taurus IC50 = 25000 nM 2838633

  Similar Natural Products in NPASS

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 NPC126481 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
0.961 High Similarity NPC32028
0.9545 High Similarity NPC47298
0.9545 High Similarity NPC315214
0.9484 High Similarity NPC159319
0.925 High Similarity NPC259545
0.9024 High Similarity NPC232340
0.8896 High Similarity NPC471294
0.8621 High Similarity NPC45850
0.8529 High Similarity NPC133306
0.8497 Intermediate Similarity NPC183805
0.8232 Intermediate Similarity NPC84508
0.8125 Intermediate Similarity NPC161292
0.8101 Intermediate Similarity NPC60553
0.7927 Intermediate Similarity NPC153769
0.7784 Intermediate Similarity NPC478032
0.7669 Intermediate Similarity NPC471598
0.7661 Intermediate Similarity NPC473057
0.7647 Intermediate Similarity NPC249040
0.7627 Intermediate Similarity NPC88363
0.7593 Intermediate Similarity NPC245657
0.7582 Intermediate Similarity NPC246700
0.7582 Intermediate Similarity NPC128751
0.7541 Intermediate Similarity NPC469497
0.7541 Intermediate Similarity NPC106833
0.7531 Intermediate Similarity NPC280853
0.7527 Intermediate Similarity NPC206186
0.75 Intermediate Similarity NPC470394
0.75 Intermediate Similarity NPC470404
0.75 Intermediate Similarity NPC470403
0.75 Intermediate Similarity NPC474409
0.7485 Intermediate Similarity NPC285016
0.7472 Intermediate Similarity NPC283152
0.7469 Intermediate Similarity NPC471596
0.7458 Intermediate Similarity NPC303225
0.7446 Intermediate Similarity NPC3715
0.743 Intermediate Similarity NPC72980
0.7429 Intermediate Similarity NPC44161
0.7418 Intermediate Similarity NPC94943
0.7414 Intermediate Similarity NPC471178
0.741 Intermediate Similarity NPC470395
0.7403 Intermediate Similarity NPC212535
0.7403 Intermediate Similarity NPC19679
0.7394 Intermediate Similarity NPC153042
0.7381 Intermediate Similarity NPC288445
0.7377 Intermediate Similarity NPC194040
0.7371 Intermediate Similarity NPC475910
0.7363 Intermediate Similarity NPC190007
0.7363 Intermediate Similarity NPC320394
0.7362 Intermediate Similarity NPC471594
0.7356 Intermediate Similarity NPC97367
0.7348 Intermediate Similarity NPC314394
0.7345 Intermediate Similarity NPC158129
0.7337 Intermediate Similarity NPC66083
0.733 Intermediate Similarity NPC154293
0.733 Intermediate Similarity NPC317430
0.7318 Intermediate Similarity NPC288943
0.7302 Intermediate Similarity NPC474188
0.7299 Intermediate Similarity NPC59779
0.7299 Intermediate Similarity NPC124542
0.7299 Intermediate Similarity NPC471177
0.7286 Intermediate Similarity NPC477110
0.7282 Intermediate Similarity NPC477111
0.7278 Intermediate Similarity NPC278451
0.7273 Intermediate Similarity NPC280964
0.7273 Intermediate Similarity NPC114335
0.7273 Intermediate Similarity NPC141915
0.7268 Intermediate Similarity NPC62069
0.7267 Intermediate Similarity NPC141353
0.7254 Intermediate Similarity NPC223427
0.7251 Intermediate Similarity NPC26872
0.7249 Intermediate Similarity NPC205403
0.7243 Intermediate Similarity NPC46580
0.7228 Intermediate Similarity NPC314002
0.7228 Intermediate Similarity NPC476319
0.7222 Intermediate Similarity NPC203754
0.7222 Intermediate Similarity NPC150048
0.7213 Intermediate Similarity NPC220765
0.7211 Intermediate Similarity NPC243834
0.7211 Intermediate Similarity NPC70956
0.7208 Intermediate Similarity NPC5145
0.7207 Intermediate Similarity NPC34508
0.72 Intermediate Similarity NPC469928
0.7193 Intermediate Similarity NPC284348
0.7189 Intermediate Similarity NPC171171
0.7188 Intermediate Similarity NPC329793
0.7186 Intermediate Similarity NPC478074
0.7181 Intermediate Similarity NPC99666
0.7179 Intermediate Similarity NPC477113
0.7174 Intermediate Similarity NPC204717
0.7167 Intermediate Similarity NPC189812
0.7167 Intermediate Similarity NPC329688
0.7166 Intermediate Similarity NPC95783
0.7151 Intermediate Similarity NPC476686
0.7151 Intermediate Similarity NPC105758
0.7151 Intermediate Similarity NPC476688
0.7143 Intermediate Similarity NPC193777
0.7143 Intermediate Similarity NPC329541
0.7135 Intermediate Similarity NPC42591
0.7135 Intermediate Similarity NPC128823
0.7128 Intermediate Similarity NPC475070
0.7126 Intermediate Similarity NPC26850
0.7114 Intermediate Similarity NPC330009
0.7111 Intermediate Similarity NPC208060
0.7111 Intermediate Similarity NPC313791
0.7107 Intermediate Similarity NPC470931
0.7105 Intermediate Similarity NPC276517
0.7102 Intermediate Similarity NPC177404
0.7102 Intermediate Similarity NPC224632
0.7098 Intermediate Similarity NPC329747
0.7097 Intermediate Similarity NPC314573
0.7092 Intermediate Similarity NPC474145
0.7092 Intermediate Similarity NPC475841
0.7085 Intermediate Similarity NPC9894
0.7079 Intermediate Similarity NPC108469
0.7065 Intermediate Similarity NPC144114
0.7065 Intermediate Similarity NPC477891
0.7062 Intermediate Similarity NPC102423
0.705 Intermediate Similarity NPC294620
0.7049 Intermediate Similarity NPC472443
0.7049 Intermediate Similarity NPC270009
0.7047 Intermediate Similarity NPC32200
0.7045 Intermediate Similarity NPC322976
0.7045 Intermediate Similarity NPC324203
0.7045 Intermediate Similarity NPC63338
0.7041 Intermediate Similarity NPC470500
0.7041 Intermediate Similarity NPC164374
0.7041 Intermediate Similarity NPC137929
0.7039 Intermediate Similarity NPC278874
0.7037 Intermediate Similarity NPC469390
0.7033 Intermediate Similarity NPC134586
0.7031 Intermediate Similarity NPC77555
0.7027 Intermediate Similarity NPC176127
0.7026 Intermediate Similarity NPC475085
0.7026 Intermediate Similarity NPC475112
0.7026 Intermediate Similarity NPC291535
0.7021 Intermediate Similarity NPC32771
0.702 Intermediate Similarity NPC18348
0.7018 Intermediate Similarity NPC257142
0.7017 Intermediate Similarity NPC472123
0.7015 Intermediate Similarity NPC471080
0.7015 Intermediate Similarity NPC469592
0.7011 Intermediate Similarity NPC198339
0.7005 Intermediate Similarity NPC476106
0.7005 Intermediate Similarity NPC472111
0.7 Intermediate Similarity NPC324149
0.7 Intermediate Similarity NPC473764
0.7 Intermediate Similarity NPC314940
0.6995 Remote Similarity NPC184964
0.6995 Remote Similarity NPC211997
0.699 Remote Similarity NPC477135
0.699 Remote Similarity NPC476098
0.6985 Remote Similarity NPC476116
0.6983 Remote Similarity NPC98187
0.6979 Remote Similarity NPC251090
0.6978 Remote Similarity NPC312872
0.6973 Remote Similarity NPC192270
0.697 Remote Similarity NPC53344
0.6968 Remote Similarity NPC254762
0.6965 Remote Similarity NPC48353
0.6963 Remote Similarity NPC279401
0.6963 Remote Similarity NPC289786
0.6963 Remote Similarity NPC79293
0.6959 Remote Similarity NPC280714
0.6957 Remote Similarity NPC67659
0.6954 Remote Similarity NPC36168
0.6954 Remote Similarity NPC118832
0.6954 Remote Similarity NPC47059
0.6954 Remote Similarity NPC264166
0.6954 Remote Similarity NPC274291
0.6954 Remote Similarity NPC165349
0.6954 Remote Similarity NPC329708
0.695 Remote Similarity NPC471304
0.6949 Remote Similarity NPC131718
0.6943 Remote Similarity NPC156704
0.6938 Remote Similarity NPC6215
0.6938 Remote Similarity NPC470126
0.6935 Remote Similarity NPC48938
0.6935 Remote Similarity NPC472444
0.6932 Remote Similarity NPC116573
0.6927 Remote Similarity NPC195314
0.6919 Remote Similarity NPC304183
0.6915 Remote Similarity NPC61350
0.6915 Remote Similarity NPC208284
0.6915 Remote Similarity NPC220337
0.6914 Remote Similarity NPC63562
0.691 Remote Similarity NPC16667
0.6907 Remote Similarity NPC192315
0.6907 Remote Similarity NPC306376
0.6906 Remote Similarity NPC280548
0.6905 Remote Similarity NPC253580
0.6902 Remote Similarity NPC293472
0.6902 Remote Similarity NPC326575
0.6902 Remote Similarity NPC151939
0.69 Remote Similarity NPC469589
0.6898 Remote Similarity NPC84478
0.6893 Remote Similarity NPC230869
0.6891 Remote Similarity NPC242209
0.689 Remote Similarity NPC256893
0.6884 Remote Similarity NPC270918
0.6884 Remote Similarity NPC283117

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC126481 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
0.9545 High Similarity NPD1684 Approved
0.9545 High Similarity NPD1685 Approved
0.8232 Intermediate Similarity NPD5497 Clinical (unspecified phase)
0.7797 Intermediate Similarity NPD5522 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD2175 Phase 3
0.7784 Intermediate Similarity NPD2176 Approved
0.7784 Intermediate Similarity NPD2177 Approved
0.773 Intermediate Similarity NPD7889 Clinical (unspecified phase)
0.7624 Intermediate Similarity NPD2383 Phase 1
0.7617 Intermediate Similarity NPD5939 Approved
0.7617 Intermediate Similarity NPD5936 Approved
0.7558 Intermediate Similarity NPD861 Approved
0.7558 Intermediate Similarity NPD862 Approved
0.7558 Intermediate Similarity NPD863 Approved
0.7542 Intermediate Similarity NPD4204 Approved
0.7542 Intermediate Similarity NPD4203 Approved
0.7514 Intermediate Similarity NPD2381 Approved
0.7514 Intermediate Similarity NPD2380 Approved
0.7514 Intermediate Similarity NPD2382 Approved
0.75 Intermediate Similarity NPD6290 Phase 2
0.75 Intermediate Similarity NPD6476 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD6158 Phase 2
0.75 Intermediate Similarity NPD3525 Discontinued
0.7472 Intermediate Similarity NPD6159 Phase 2
0.7461 Intermediate Similarity NPD2916 Discontinued
0.7447 Intermediate Similarity NPD2727 Phase 2
0.7414 Intermediate Similarity NPD926 Approved
0.7414 Intermediate Similarity NPD925 Approved
0.7386 Intermediate Similarity NPD1326 Approved
0.7386 Intermediate Similarity NPD1325 Approved
0.738 Intermediate Similarity NPD6491 Clinical (unspecified phase)
0.7347 Intermediate Similarity NPD4502 Phase 2
0.7333 Intermediate Similarity NPD1503 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD4669 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD4670 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD4671 Clinical (unspecified phase)
0.7294 Intermediate Similarity NPD2882 Phase 1
0.7288 Intermediate Similarity NPD7474 Suspended
0.7287 Intermediate Similarity NPD3810 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD425 Approved
0.7273 Intermediate Similarity NPD424 Approved
0.7268 Intermediate Similarity NPD5083 Clinical (unspecified phase)
0.7247 Intermediate Similarity NPD1078 Clinical (unspecified phase)
0.7238 Intermediate Similarity NPD3920 Phase 2
0.7228 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD8109 Clinical (unspecified phase)
0.7207 Intermediate Similarity NPD7418 Discontinued
0.7167 Intermediate Similarity NPD6492 Phase 2
0.715 Intermediate Similarity NPD4511 Phase 1
0.7143 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD3330 Phase 1
0.7135 Intermediate Similarity NPD2762 Phase 2
0.7135 Intermediate Similarity NPD2781 Approved
0.7127 Intermediate Similarity NPD5100 Phase 3
0.7126 Intermediate Similarity NPD1592 Phase 3
0.7119 Intermediate Similarity NPD2782 Approved
0.7119 Intermediate Similarity NPD2780 Approved
0.7086 Intermediate Similarity NPD5255 Approved
0.7086 Intermediate Similarity NPD604 Clinical (unspecified phase)
0.7072 Intermediate Similarity NPD5065 Approved
0.7047 Intermediate Similarity NPD8395 Approved
0.7047 Intermediate Similarity NPD8396 Approved
0.7045 Intermediate Similarity NPD9398 Clinical (unspecified phase)
0.7031 Intermediate Similarity NPD7948 Phase 1
0.7027 Intermediate Similarity NPD5596 Phase 2
0.7024 Intermediate Similarity NPD7726 Phase 1
0.702 Intermediate Similarity NPD6376 Discontinued
0.7019 Intermediate Similarity NPD5352 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD4702 Approved
0.7018 Intermediate Similarity NPD4703 Approved
0.7016 Intermediate Similarity NPD6590 Discontinued
0.7005 Intermediate Similarity NPD5530 Phase 1
0.6995 Remote Similarity NPD5751 Clinical (unspecified phase)
0.699 Remote Similarity NPD4044 Discontinued
0.6984 Remote Similarity NPD6281 Approved
0.6973 Remote Similarity NPD7414 Clinical (unspecified phase)
0.697 Remote Similarity NPD7222 Phase 2
0.6966 Remote Similarity NPD444 Approved
0.6957 Remote Similarity NPD3417 Phase 1
0.6954 Remote Similarity NPD4038 Approved
0.6954 Remote Similarity NPD4035 Approved
0.6954 Remote Similarity NPD4037 Approved
0.6954 Remote Similarity NPD4033 Approved
0.6954 Remote Similarity NPD32 Approved
0.6954 Remote Similarity NPD4039 Approved
0.6954 Remote Similarity NPD31 Approved
0.6954 Remote Similarity NPD4034 Approved
0.6954 Remote Similarity NPD4036 Approved
0.6954 Remote Similarity NPD4122 Approved
0.6952 Remote Similarity NPD3082 Discontinued
0.6944 Remote Similarity NPD6872 Clinical (unspecified phase)
0.6941 Remote Similarity NPD3813 Approved
0.6935 Remote Similarity NPD7672 Approved
0.6935 Remote Similarity NPD7671 Approved
0.6915 Remote Similarity NPD5256 Discontinued
0.6914 Remote Similarity NPD5257 Clinical (unspecified phase)
0.6911 Remote Similarity NPD3404 Approved
0.6911 Remote Similarity NPD6569 Phase 2
0.6906 Remote Similarity NPD4724 Clinical (unspecified phase)
0.6904 Remote Similarity NPD6991 Approved
0.6897 Remote Similarity NPD9706 Clinical (unspecified phase)
0.6891 Remote Similarity NPD5512 Phase 3
0.6889 Remote Similarity NPD4554 Clinical (unspecified phase)
0.6884 Remote Similarity NPD3930 Clinical (unspecified phase)
0.6875 Remote Similarity NPD1038 Approved
0.6875 Remote Similarity NPD6026 Approved
0.6872 Remote Similarity NPD5140 Approved
0.6872 Remote Similarity NPD5138 Approved
0.6865 Remote Similarity NPD1620 Clinical (unspecified phase)
0.6862 Remote Similarity NPD6227 Discontinued
0.6859 Remote Similarity NPD5912 Clinical (unspecified phase)
0.6859 Remote Similarity NPD5913 Phase 3
0.6853 Remote Similarity NPD3928 Approved
0.6853 Remote Similarity NPD3931 Approved
0.6852 Remote Similarity NPD995 Clinical (unspecified phase)
0.6851 Remote Similarity NPD2844 Phase 3
0.6848 Remote Similarity NPD6375 Clinical (unspecified phase)
0.6836 Remote Similarity NPD9382 Approved
0.6836 Remote Similarity NPD9383 Approved
0.6834 Remote Similarity NPD3932 Clinical (unspecified phase)
0.6833 Remote Similarity NPD5744 Clinical (unspecified phase)
0.6832 Remote Similarity NPD6220 Phase 3
0.6831 Remote Similarity NPD3224 Phase 2
0.6827 Remote Similarity NPD6824 Clinical (unspecified phase)
0.6823 Remote Similarity NPD3923 Approved
0.6823 Remote Similarity NPD3922 Approved
0.6823 Remote Similarity NPD3924 Approved
0.6823 Remote Similarity NPD3921 Approved
0.68 Remote Similarity NPD7453 Approved
0.68 Remote Similarity NPD5429 Discontinued
0.68 Remote Similarity NPD7452 Approved
0.6793 Remote Similarity NPD9690 Approved
0.6791 Remote Similarity NPD7867 Phase 1
0.6788 Remote Similarity NPD9695 Approved
0.6786 Remote Similarity NPD3814 Phase 1
0.6784 Remote Similarity NPD3717 Discontinued
0.678 Remote Similarity NPD6803 Clinical (unspecified phase)
0.6774 Remote Similarity NPD5398 Clinical (unspecified phase)
0.6771 Remote Similarity NPD4699 Discontinued
0.6769 Remote Similarity NPD2952 Discontinued
0.6769 Remote Similarity NPD5003 Discontinued
0.6768 Remote Similarity NPD6975 Discontinued
0.6768 Remote Similarity NPD947 Approved
0.6765 Remote Similarity NPD3243 Approved
0.676 Remote Similarity NPD9705 Discontinued
0.676 Remote Similarity NPD112 Approved
0.6758 Remote Similarity NPD5021 Discontinued
0.6754 Remote Similarity NPD4021 Phase 2
0.6753 Remote Similarity NPD6251 Discontinued
0.6751 Remote Similarity NPD4396 Clinical (unspecified phase)
0.6751 Remote Similarity NPD484 Approved
0.675 Remote Similarity NPD3003 Approved
0.6748 Remote Similarity NPD5164 Discontinued
0.6742 Remote Similarity NPD2581 Approved
0.6742 Remote Similarity NPD2582 Approved
0.6726 Remote Similarity NPD3864 Clinical (unspecified phase)
0.6722 Remote Similarity NPD972 Clinical (unspecified phase)
0.672 Remote Similarity NPD6641 Approved
0.672 Remote Similarity NPD4072 Approved
0.672 Remote Similarity NPD4071 Approved
0.672 Remote Similarity NPD6642 Approved
0.6717 Remote Similarity NPD6592 Clinical (unspecified phase)
0.6705 Remote Similarity NPD1305 Clinical (unspecified phase)
0.6701 Remote Similarity NPD802 Phase 2
0.6701 Remote Similarity NPD1768 Approved
0.6701 Remote Similarity NPD1304 Clinical (unspecified phase)
0.67 Remote Similarity NPD4795 Phase 2
0.67 Remote Similarity NPD6138 Clinical (unspecified phase)
0.6698 Remote Similarity NPD5040 Clinical (unspecified phase)
0.6687 Remote Similarity NPD1251 Discontinued
0.6686 Remote Similarity NPD6506 Clinical (unspecified phase)
0.6685 Remote Similarity NPD5934 Clinical (unspecified phase)
0.6684 Remote Similarity NPD4076 Approved
0.6684 Remote Similarity NPD4079 Approved
0.6684 Remote Similarity NPD4889 Approved
0.6683 Remote Similarity NPD5669 Clinical (unspecified phase)
0.6683 Remote Similarity NPD5658 Approved
0.6667 Remote Similarity NPD4638 Approved
0.6667 Remote Similarity NPD6861 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7219 Approved
0.6667 Remote Similarity NPD7221 Approved
0.6667 Remote Similarity NPD5416 Discontinued
0.6667 Remote Similarity NPD1740 Approved
0.6667 Remote Similarity NPD3324 Clinical (unspecified phase)
0.6667 Remote Similarity NPD1739 Approved
0.6667 Remote Similarity NPD4640 Approved
0.6667 Remote Similarity NPD5862 Discovery
0.6667 Remote Similarity NPD4305 Clinical (unspecified phase)
0.6667 Remote Similarity NPD4639 Approved
0.6667 Remote Similarity NPD9714 Clinical (unspecified phase)
0.665 Remote Similarity NPD4437 Phase 3
0.665 Remote Similarity NPD5417 Clinical (unspecified phase)
0.665 Remote Similarity NPD4897 Phase 2
0.6649 Remote Similarity NPD6182 Approved
0.6649 Remote Similarity NPD4375 Approved
0.6649 Remote Similarity NPD43 Approved
0.6649 Remote Similarity NPD6183 Clinical (unspecified phase)
0.6648 Remote Similarity NPD4463 Approved
0.6648 Remote Similarity NPD4462 Approved

Structure

External Identifiers

PubChem CID   44586221
ChEMBL   CHEMBL455781
ZINC  

Physicochemical Properties

Molecular Weight:  258.14
ALogP:  -0.9209
MLogP:  2.67
XLogP:  0.347
# Rotatable Bonds:  5
Polar Surface Area:  79.37
# H-Bond Aceptor:  3
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  19

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
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