Natural Product: NPC274895

Natural Product ID:  NPC274895
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C16H23NO2
Standard InCHIKey:  ZAPIKGUBFZHNMQ-AQDIXCGQSA-N
Standard InCHI:  InChI=1S/C16H23NO2/c1-10-8-11-12-4-2-6-17-7-3-5-13(15(19)14(11)18)16(12,17)9-10/h8,11-14,18H,2-7,9H2,1H3/t11-,12-,13-,14+,16-/m1/s1
Canonical SMILES:  CC1=C[C@H]2[C@H](O)C(=O)[C@@H]3[C@@]4(C1)[C@@H]2CCCN4CCC3
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
NPO32462 lycopodium serratum Species Lycopodiaceae Eukaryota PMID[17503851]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT204 Individual Protein Acetylcholinesterase Homo sapiens IC50 = 16700 nM 23398362

  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 NPC274895 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
0.75 Intermediate Similarity NPC475239
0.7 Intermediate Similarity NPC478137
0.6923 Remote Similarity NPC46981
0.6923 Remote Similarity NPC48362
0.6875 Remote Similarity NPC289140
0.678 Remote Similarity NPC176773
0.6759 Remote Similarity NPC73064
0.6754 Remote Similarity NPC91604
0.6752 Remote Similarity NPC212874
0.6744 Remote Similarity NPC96010
0.6744 Remote Similarity NPC317654
0.6729 Remote Similarity NPC133954
0.6724 Remote Similarity NPC176012
0.6696 Remote Similarity NPC23170
0.6667 Remote Similarity NPC474164
0.6667 Remote Similarity NPC475862
0.6667 Remote Similarity NPC474525
0.6667 Remote Similarity NPC74363
0.6667 Remote Similarity NPC328264
0.6667 Remote Similarity NPC213412
0.6667 Remote Similarity NPC20688
0.6667 Remote Similarity NPC94666
0.6667 Remote Similarity NPC51014
0.6667 Remote Similarity NPC473420
0.6638 Remote Similarity NPC77703
0.6636 Remote Similarity NPC180834
0.6636 Remote Similarity NPC474245
0.6615 Remote Similarity NPC470537
0.6614 Remote Similarity NPC238323
0.6609 Remote Similarity NPC220111
0.6604 Remote Similarity NPC151519
0.6579 Remote Similarity NPC62516
0.6579 Remote Similarity NPC157113
0.6577 Remote Similarity NPC46441
0.6577 Remote Similarity NPC312637
0.6549 Remote Similarity NPC245972
0.6549 Remote Similarity NPC196485
0.6549 Remote Similarity NPC474328
0.6545 Remote Similarity NPC473242
0.6545 Remote Similarity NPC470629
0.6545 Remote Similarity NPC181225
0.6545 Remote Similarity NPC206060
0.6545 Remote Similarity NPC472802
0.6545 Remote Similarity NPC290690
0.6545 Remote Similarity NPC474512
0.6545 Remote Similarity NPC230387
0.6545 Remote Similarity NPC17733
0.6545 Remote Similarity NPC471722
0.6532 Remote Similarity NPC135431
0.6522 Remote Similarity NPC140300
0.6518 Remote Similarity NPC99380
0.6518 Remote Similarity NPC168027
0.6518 Remote Similarity NPC185936
0.6514 Remote Similarity NPC158393
0.6514 Remote Similarity NPC477579
0.6514 Remote Similarity NPC95594
0.6514 Remote Similarity NPC235341
0.6509 Remote Similarity NPC14151
0.6489 Remote Similarity NPC280903
0.6486 Remote Similarity NPC198664
0.6486 Remote Similarity NPC76879
0.6486 Remote Similarity NPC143232
0.6486 Remote Similarity NPC119416
0.6486 Remote Similarity NPC69627
0.6486 Remote Similarity NPC470588
0.6486 Remote Similarity NPC274330
0.6481 Remote Similarity NPC221758
0.6481 Remote Similarity NPC59453
0.648 Remote Similarity NPC209252
0.648 Remote Similarity NPC470538
0.646 Remote Similarity NPC12722
0.646 Remote Similarity NPC211230
0.6455 Remote Similarity NPC293564
0.6455 Remote Similarity NPC18064
0.6455 Remote Similarity NPC142415
0.6455 Remote Similarity NPC51700
0.6455 Remote Similarity NPC171203
0.6455 Remote Similarity NPC68160
0.6455 Remote Similarity NPC71507
0.6455 Remote Similarity NPC242468
0.6455 Remote Similarity NPC88716
0.6455 Remote Similarity NPC102683
0.6455 Remote Similarity NPC298904
0.6455 Remote Similarity NPC98442
0.6455 Remote Similarity NPC475740
0.6455 Remote Similarity NPC130577
0.6455 Remote Similarity NPC307426
0.6449 Remote Similarity NPC310989
0.6449 Remote Similarity NPC73882
0.6446 Remote Similarity NPC476276
0.6442 Remote Similarity NPC197659
0.6441 Remote Similarity NPC476755
0.6435 Remote Similarity NPC476903
0.6429 Remote Similarity NPC111110
0.6429 Remote Similarity NPC85173
0.6429 Remote Similarity NPC291028
0.6429 Remote Similarity NPC470589
0.6429 Remote Similarity NPC126369
0.6423 Remote Similarity NPC143173
0.6422 Remote Similarity NPC470574
0.6417 Remote Similarity NPC86906
0.6415 Remote Similarity NPC2482
0.641 Remote Similarity NPC15390
0.641 Remote Similarity NPC472972
0.6396 Remote Similarity NPC40552
0.6396 Remote Similarity NPC52169
0.6396 Remote Similarity NPC328539
0.6396 Remote Similarity NPC246708
0.6396 Remote Similarity NPC182797
0.6393 Remote Similarity NPC147835
0.6393 Remote Similarity NPC85001
0.6393 Remote Similarity NPC95920
0.6393 Remote Similarity NPC253645
0.6393 Remote Similarity NPC218602
0.6389 Remote Similarity NPC64600
0.6387 Remote Similarity NPC98765
0.6387 Remote Similarity NPC275583
0.6372 Remote Similarity NPC65120
0.6372 Remote Similarity NPC233455
0.6372 Remote Similarity NPC105189
0.6372 Remote Similarity NPC301244
0.6372 Remote Similarity NPC272746
0.6372 Remote Similarity NPC145067
0.6372 Remote Similarity NPC187722
0.6372 Remote Similarity NPC38754
0.6372 Remote Similarity NPC4036
0.6372 Remote Similarity NPC158030
0.6371 Remote Similarity NPC124358
0.6364 Remote Similarity NPC474733
0.6364 Remote Similarity NPC474732
0.6364 Remote Similarity NPC327115
0.6364 Remote Similarity NPC72133
0.6364 Remote Similarity NPC472986
0.6364 Remote Similarity NPC472985
0.6364 Remote Similarity NPC473226
0.6364 Remote Similarity NPC73038
0.6364 Remote Similarity NPC145879
0.6364 Remote Similarity NPC31564
0.6364 Remote Similarity NPC72638
0.6364 Remote Similarity NPC325594
0.6364 Remote Similarity NPC472974
0.6364 Remote Similarity NPC94755
0.6364 Remote Similarity NPC82979
0.6364 Remote Similarity NPC470955
0.6364 Remote Similarity NPC474778
0.6356 Remote Similarity NPC118964
0.6355 Remote Similarity NPC121984
0.6355 Remote Similarity NPC3915
0.6348 Remote Similarity NPC280725
0.6341 Remote Similarity NPC473232
0.6339 Remote Similarity NPC86319
0.6339 Remote Similarity NPC1015
0.6339 Remote Similarity NPC64872
0.6339 Remote Similarity NPC32830
0.6339 Remote Similarity NPC122116
0.6339 Remote Similarity NPC59263
0.6339 Remote Similarity NPC293048
0.6339 Remote Similarity NPC95246
0.6339 Remote Similarity NPC225585
0.6339 Remote Similarity NPC61543
0.6339 Remote Similarity NPC31985
0.6339 Remote Similarity NPC121798
0.6339 Remote Similarity NPC161751
0.6339 Remote Similarity NPC275740
0.6339 Remote Similarity NPC127689
0.6339 Remote Similarity NPC263393
0.6339 Remote Similarity NPC130520
0.6339 Remote Similarity NPC474972
0.6339 Remote Similarity NPC290972
0.6339 Remote Similarity NPC270768
0.6339 Remote Similarity NPC234346
0.6339 Remote Similarity NPC25906
0.6339 Remote Similarity NPC474686
0.633 Remote Similarity NPC237712
0.632 Remote Similarity NPC477963
0.6316 Remote Similarity NPC202728
0.6316 Remote Similarity NPC474806
0.6316 Remote Similarity NPC272075
0.6316 Remote Similarity NPC133579
0.6316 Remote Similarity NPC295643
0.6316 Remote Similarity NPC214756
0.6316 Remote Similarity NPC229281
0.6316 Remote Similarity NPC158059
0.6316 Remote Similarity NPC134826
0.6316 Remote Similarity NPC118519
0.6306 Remote Similarity NPC159046
0.6306 Remote Similarity NPC474684
0.6306 Remote Similarity NPC233836
0.6306 Remote Similarity NPC58063
0.6306 Remote Similarity NPC142361
0.6306 Remote Similarity NPC187376
0.6296 Remote Similarity NPC103486
0.6296 Remote Similarity NPC212083
0.6296 Remote Similarity NPC163236
0.6293 Remote Similarity NPC305483
0.6293 Remote Similarity NPC192428
0.6293 Remote Similarity NPC96859
0.6293 Remote Similarity NPC328162
0.6283 Remote Similarity NPC130278
0.6283 Remote Similarity NPC193750

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC274895 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
0.6726 Remote Similarity NPD5349 Clinical (unspecified phase)
0.6604 Remote Similarity NPD3667 Approved
0.6514 Remote Similarity NPD3618 Phase 1
0.6481 Remote Similarity NPD4786 Approved
0.6417 Remote Similarity NPD7333 Discontinued
0.6372 Remote Similarity NPD7515 Phase 2
0.6357 Remote Similarity NPD6909 Approved
0.6357 Remote Similarity NPD6908 Approved
0.6339 Remote Similarity NPD5328 Approved
0.6293 Remote Similarity NPD4697 Phase 3
0.6293 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6293 Remote Similarity NPD5222 Approved
0.6293 Remote Similarity NPD5221 Approved
0.6281 Remote Similarity NPD6920 Discontinued
0.6239 Remote Similarity NPD5173 Approved
0.6239 Remote Similarity NPD4755 Approved
0.6228 Remote Similarity NPD6079 Approved
0.6216 Remote Similarity NPD5279 Phase 3
0.6182 Remote Similarity NPD3133 Approved
0.6182 Remote Similarity NPD3665 Phase 1
0.6182 Remote Similarity NPD3666 Approved
0.6174 Remote Similarity NPD4202 Approved
0.6134 Remote Similarity NPD5285 Approved
0.6134 Remote Similarity NPD4700 Approved
0.6134 Remote Similarity NPD5286 Approved
0.6134 Remote Similarity NPD4696 Approved
0.6121 Remote Similarity NPD7748 Approved
0.6111 Remote Similarity NPD4695 Discontinued
0.6083 Remote Similarity NPD5223 Approved
0.6053 Remote Similarity NPD4753 Phase 2
0.6036 Remote Similarity NPD3668 Phase 3
0.6033 Remote Similarity NPD5224 Approved
0.6033 Remote Similarity NPD5211 Phase 2
0.6033 Remote Similarity NPD4633 Approved
0.6033 Remote Similarity NPD5226 Approved
0.6033 Remote Similarity NPD5225 Approved
0.5984 Remote Similarity NPD5174 Approved
0.5984 Remote Similarity NPD4754 Approved
0.5984 Remote Similarity NPD5175 Approved
0.5966 Remote Similarity NPD7902 Approved
0.5935 Remote Similarity NPD5141 Approved
0.5929 Remote Similarity NPD8415 Approved
0.592 Remote Similarity NPD6415 Discontinued
0.5897 Remote Similarity NPD6399 Phase 3
0.5893 Remote Similarity NPD4197 Approved
0.5887 Remote Similarity NPD7128 Approved
0.5887 Remote Similarity NPD4767 Approved
0.5887 Remote Similarity NPD6675 Approved
0.5887 Remote Similarity NPD5739 Approved
0.5887 Remote Similarity NPD4768 Approved
0.5887 Remote Similarity NPD6402 Approved
0.5887 Remote Similarity NPD8387 Clinical (unspecified phase)
0.5872 Remote Similarity NPD7645 Phase 2
0.5865 Remote Similarity NPD6921 Approved
0.5841 Remote Similarity NPD5329 Approved
0.5841 Remote Similarity NPD7520 Clinical (unspecified phase)
0.584 Remote Similarity NPD5701 Approved
0.584 Remote Similarity NPD5697 Approved
0.5833 Remote Similarity NPD7517 Approved
0.5833 Remote Similarity NPD7519 Approved
0.5833 Remote Similarity NPD7518 Approved
0.5798 Remote Similarity NPD4629 Approved
0.5798 Remote Similarity NPD5210 Approved
0.5794 Remote Similarity NPD7320 Approved
0.5794 Remote Similarity NPD4730 Approved
0.5794 Remote Similarity NPD6899 Approved
0.5794 Remote Similarity NPD5168 Approved
0.5794 Remote Similarity NPD5128 Approved
0.5794 Remote Similarity NPD6881 Approved
0.5794 Remote Similarity NPD4729 Approved
0.5794 Remote Similarity NPD6011 Approved
0.5789 Remote Similarity NPD5690 Phase 2
0.5789 Remote Similarity NPD4694 Approved
0.5789 Remote Similarity NPD5280 Approved
0.578 Remote Similarity NPD3617 Approved
0.5776 Remote Similarity NPD5764 Clinical (unspecified phase)
0.5776 Remote Similarity NPD7285 Clinical (unspecified phase)
0.5776 Remote Similarity NPD6101 Approved
0.5748 Remote Similarity NPD6012 Approved
0.5748 Remote Similarity NPD6373 Approved
0.5748 Remote Similarity NPD6013 Approved
0.5748 Remote Similarity NPD6372 Approved
0.5748 Remote Similarity NPD6014 Approved
0.5741 Remote Similarity NPD3701 Clinical (unspecified phase)
0.5739 Remote Similarity NPD3573 Approved
0.5734 Remote Similarity NPD5119 Approved
0.5734 Remote Similarity NPD5121 Approved
0.5734 Remote Similarity NPD5120 Approved
0.5714 Remote Similarity NPD7901 Clinical (unspecified phase)
0.5714 Remote Similarity NPD7260 Phase 2
0.5714 Remote Similarity NPD7900 Approved
0.5714 Remote Similarity NPD4223 Phase 3
0.5714 Remote Similarity NPD4221 Approved
0.5703 Remote Similarity NPD5250 Approved
0.5703 Remote Similarity NPD5247 Approved
0.5703 Remote Similarity NPD5169 Approved
0.5703 Remote Similarity NPD5135 Approved
0.5703 Remote Similarity NPD6883 Approved
0.5703 Remote Similarity NPD5248 Approved
0.5703 Remote Similarity NPD5134 Clinical (unspecified phase)
0.5703 Remote Similarity NPD5249 Phase 3
0.5703 Remote Similarity NPD7290 Approved
0.5703 Remote Similarity NPD4634 Approved
0.5703 Remote Similarity NPD7102 Approved
0.5703 Remote Similarity NPD5251 Approved
0.5702 Remote Similarity NPD6083 Phase 2
0.5702 Remote Similarity NPD6084 Phase 2
0.5694 Remote Similarity NPD6333 Approved
0.5694 Remote Similarity NPD6334 Approved
0.5678 Remote Similarity NPD6411 Approved
0.5676 Remote Similarity NPD8259 Clinical (unspecified phase)
0.5674 Remote Similarity NPD6845 Suspended
0.5667 Remote Similarity NPD5695 Phase 3
0.5664 Remote Similarity NPD7714 Approved
0.5664 Remote Similarity NPD7715 Approved
0.5662 Remote Similarity NPD7122 Discontinued
0.5659 Remote Similarity NPD6869 Approved
0.5659 Remote Similarity NPD6401 Clinical (unspecified phase)
0.5659 Remote Similarity NPD6847 Approved
0.5659 Remote Similarity NPD6617 Approved
0.5659 Remote Similarity NPD5215 Approved
0.5659 Remote Similarity NPD5217 Approved
0.5659 Remote Similarity NPD6649 Approved
0.5659 Remote Similarity NPD8130 Phase 1
0.5659 Remote Similarity NPD6650 Approved
0.5659 Remote Similarity NPD5127 Approved
0.5659 Remote Similarity NPD5216 Approved
0.5652 Remote Similarity NPD5158 Clinical (unspecified phase)
0.5652 Remote Similarity NPD3574 Clinical (unspecified phase)
0.5652 Remote Similarity NPD5159 Phase 2
0.5652 Remote Similarity NPD5157 Phase 1
0.5648 Remote Similarity NPD6942 Approved
0.5648 Remote Similarity NPD7339 Approved
0.562 Remote Similarity NPD2609 Approved
0.562 Remote Similarity NPD4217 Approved
0.562 Remote Similarity NPD3131 Approved
0.562 Remote Similarity NPD4215 Approved
0.562 Remote Similarity NPD2612 Approved
0.562 Remote Similarity NPD3132 Approved
0.562 Remote Similarity NPD2610 Approved
0.562 Remote Similarity NPD4218 Approved
0.562 Remote Similarity NPD2608 Approved
0.562 Remote Similarity NPD4216 Approved
0.562 Remote Similarity NPD2611 Approved
0.5615 Remote Similarity NPD8297 Approved
0.5615 Remote Similarity NPD6882 Approved

Structure

External Identifiers

PubChem CID   11076230
ChEMBL   CHEMBL229334
ZINC  

Physicochemical Properties

Molecular Weight:  261.17
ALogP:  -0.716
MLogP:  2.89
XLogP:  0.936
# Rotatable Bonds:  2
Polar Surface Area:  40.54
# H-Bond Aceptor:  3
# H-Bond Donor:  1
# Rings:  4
# Heavy Atoms:  19

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs