Natural Product: NPC12275

Natural Product ID:  NPC12275
Common Name:   Dalbergiphenol
IUPAC Name:   2,4-dimethoxy-5-(1-phenylprop-2-enyl)phenol
Synonyms:   Dalbergiphenol
Molecular Formula:   C17H18O3
Standard InCHIKey:  SLLCQEPKLKMZKP-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C17H18O3/c1-4-13(12-8-6-5-7-9-12)14-10-15(18)17(20-3)11-16(14)19-2/h4-11,13,18H,1H2,2-3H3
Canonical SMILES:  C=CC(c1cc(O)c(cc1OC)OC)c1ccccc1
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
NPO29428 Dalbergia cochinchinensis Species Fabaceae Eukaryota PMID[12932142]
NPO29428 Dalbergia cochinchinensis Species Fabaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Inhibition = 8.2 % 12932142
NPT2 Others Unspecified Inhibition = 18.9 % 12932142
NPT2 Others Unspecified Inhibition = 51.8 % 12932142
NPT2 Others Unspecified EC50 = 98000 nM 24803361

  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 NPC12275 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 NPC45715
1.0 High Similarity NPC474356
0.992 High Similarity NPC6451
0.984 High Similarity NPC232275
0.9839 High Similarity NPC190144
0.976 High Similarity NPC299221
0.976 High Similarity NPC234488
0.976 High Similarity NPC224157
0.976 High Similarity NPC311680
0.976 High Similarity NPC192687
0.976 High Similarity NPC51840
0.968 High Similarity NPC58164
0.968 High Similarity NPC10225
0.96 High Similarity NPC266691
0.952 High Similarity NPC82679
0.952 High Similarity NPC74817
0.952 High Similarity NPC159968
0.952 High Similarity NPC127587
0.952 High Similarity NPC236791
0.952 High Similarity NPC124452
0.952 High Similarity NPC324112
0.952 High Similarity NPC169474
0.952 High Similarity NPC246620
0.952 High Similarity NPC282000
0.952 High Similarity NPC293054
0.9516 High Similarity NPC60885
0.9516 High Similarity NPC234400
0.9466 High Similarity NPC25966
0.9466 High Similarity NPC127218
0.9466 High Similarity NPC292882
0.9466 High Similarity NPC319647
0.9466 High Similarity NPC245207
0.9449 High Similarity NPC126836
0.9444 High Similarity NPC154866
0.944 High Similarity NPC44748
0.944 High Similarity NPC76451
0.944 High Similarity NPC223136
0.944 High Similarity NPC103823
0.944 High Similarity NPC18924
0.944 High Similarity NPC28730
0.944 High Similarity NPC78974
0.944 High Similarity NPC214406
0.9394 High Similarity NPC284464
0.9394 High Similarity NPC160283
0.9394 High Similarity NPC254759
0.9389 High Similarity NPC90615
0.9389 High Similarity NPC6262
0.9389 High Similarity NPC276490
0.9389 High Similarity NPC201145
0.9389 High Similarity NPC73535
0.9389 High Similarity NPC272157
0.9389 High Similarity NPC25111
0.9375 High Similarity NPC474017
0.9365 High Similarity NPC266555
0.936 High Similarity NPC265483
0.936 High Similarity NPC193544
0.936 High Similarity NPC233410
0.936 High Similarity NPC208950
0.936 High Similarity NPC105925
0.936 High Similarity NPC298757
0.936 High Similarity NPC82483
0.936 High Similarity NPC203133
0.936 High Similarity NPC221077
0.936 High Similarity NPC116907
0.936 High Similarity NPC117214
0.936 High Similarity NPC251855
0.936 High Similarity NPC17943
0.936 High Similarity NPC472093
0.936 High Similarity NPC299584
0.936 High Similarity NPC475169
0.936 High Similarity NPC57490
0.9323 High Similarity NPC471389
0.9318 High Similarity NPC79622
0.9318 High Similarity NPC30951
0.9318 High Similarity NPC212942
0.9318 High Similarity NPC29868
0.9318 High Similarity NPC6369
0.9313 High Similarity NPC265433
0.9313 High Similarity NPC248727
0.9313 High Similarity NPC173660
0.9313 High Similarity NPC270456
0.9313 High Similarity NPC472336
0.9313 High Similarity NPC300846
0.9313 High Similarity NPC472334
0.9313 High Similarity NPC476639
0.9313 High Similarity NPC114155
0.9313 High Similarity NPC162659
0.9308 High Similarity NPC276026
0.9308 High Similarity NPC206737
0.9308 High Similarity NPC469659
0.9308 High Similarity NPC56764
0.9308 High Similarity NPC106215
0.9308 High Similarity NPC7515
0.9308 High Similarity NPC188378
0.9308 High Similarity NPC555
0.9308 High Similarity NPC289258
0.9308 High Similarity NPC103967
0.9297 High Similarity NPC214860
0.9291 High Similarity NPC28765
0.9286 High Similarity NPC112596
0.9286 High Similarity NPC223953
0.9286 High Similarity NPC245060
0.928 High Similarity NPC183446
0.928 High Similarity NPC206487
0.928 High Similarity NPC5796
0.9274 High Similarity NPC135414
0.9274 High Similarity NPC41562
0.9254 High Similarity NPC107161
0.9248 High Similarity NPC73505
0.9248 High Similarity NPC165026
0.9248 High Similarity NPC259519
0.9248 High Similarity NPC34431
0.9248 High Similarity NPC295719
0.9242 High Similarity NPC326797
0.9242 High Similarity NPC103976
0.9242 High Similarity NPC107551
0.9242 High Similarity NPC102904
0.9242 High Similarity NPC176051
0.9242 High Similarity NPC474282
0.9237 High Similarity NPC283009
0.9237 High Similarity NPC55239
0.9237 High Similarity NPC195022
0.9237 High Similarity NPC472337
0.9237 High Similarity NPC313081
0.9237 High Similarity NPC240279
0.9237 High Similarity NPC261873
0.9237 High Similarity NPC256262
0.9237 High Similarity NPC180602
0.9237 High Similarity NPC111655
0.9237 High Similarity NPC214853
0.9231 High Similarity NPC158331
0.9231 High Similarity NPC32778
0.9219 High Similarity NPC170844
0.9219 High Similarity NPC476968
0.9219 High Similarity NPC212015
0.9219 High Similarity NPC45824
0.9213 High Similarity NPC236760
0.9213 High Similarity NPC252131
0.92 High Similarity NPC95168
0.92 High Similarity NPC228922
0.92 High Similarity NPC282496
0.92 High Similarity NPC233526
0.92 High Similarity NPC197757
0.92 High Similarity NPC136319
0.92 High Similarity NPC121115
0.9194 High Similarity NPC285289
0.9185 High Similarity NPC477616
0.9179 High Similarity NPC247291
0.9179 High Similarity NPC311530
0.9173 High Similarity NPC260741
0.9173 High Similarity NPC471388
0.9173 High Similarity NPC184613
0.9173 High Similarity NPC70682
0.9167 High Similarity NPC143139
0.9167 High Similarity NPC205442
0.9167 High Similarity NPC197166
0.9167 High Similarity NPC133025
0.9167 High Similarity NPC202846
0.916 High Similarity NPC209199
0.916 High Similarity NPC317380
0.916 High Similarity NPC287745
0.9154 High Similarity NPC218884
0.9154 High Similarity NPC202762
0.9154 High Similarity NPC127624
0.9154 High Similarity NPC175067
0.9154 High Similarity NPC86655
0.9154 High Similarity NPC204215
0.9141 High Similarity NPC186843
0.9141 High Similarity NPC206615
0.9141 High Similarity NPC470213
0.9141 High Similarity NPC98631
0.912 High Similarity NPC262253
0.912 High Similarity NPC474864
0.912 High Similarity NPC246967
0.912 High Similarity NPC71579
0.912 High Similarity NPC473411
0.9118 High Similarity NPC280092
0.9118 High Similarity NPC12641
0.9118 High Similarity NPC93323
0.9118 High Similarity NPC45257
0.9111 High Similarity NPC175838
0.9104 High Similarity NPC184797
0.9104 High Similarity NPC27495
0.9104 High Similarity NPC309124
0.9098 High Similarity NPC156948
0.9098 High Similarity NPC46277
0.9098 High Similarity NPC86605
0.9098 High Similarity NPC3072
0.9098 High Similarity NPC301765
0.9091 High Similarity NPC200557
0.9091 High Similarity NPC255147
0.9091 High Similarity NPC158142
0.9091 High Similarity NPC69029
0.9091 High Similarity NPC10314
0.9091 High Similarity NPC94750
0.9091 High Similarity NPC99572
0.9091 High Similarity NPC474206
0.9091 High Similarity NPC112939
0.9091 High Similarity NPC126409
0.9091 High Similarity NPC470356

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC12275 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
0.9219 High Similarity NPD3027 Phase 3
0.8846 High Similarity NPD1529 Clinical (unspecified phase)
0.8769 High Similarity NPD1530 Clinical (unspecified phase)
0.8722 High Similarity NPD1612 Clinical (unspecified phase)
0.8722 High Similarity NPD1613 Approved
0.8346 Intermediate Similarity NPD3018 Phase 2
0.832 Intermediate Similarity NPD5283 Phase 1
0.8308 Intermediate Similarity NPD1610 Phase 2
0.8306 Intermediate Similarity NPD228 Approved
0.8284 Intermediate Similarity NPD4908 Phase 1
0.8209 Intermediate Similarity NPD2861 Phase 2
0.8182 Intermediate Similarity NPD2982 Phase 2
0.8182 Intermediate Similarity NPD2983 Phase 2
0.8162 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.8121 Intermediate Similarity NPD2801 Approved
0.8106 Intermediate Similarity NPD2981 Phase 2
0.8045 Intermediate Similarity NPD4749 Approved
0.8 Intermediate Similarity NPD3021 Approved
0.8 Intermediate Similarity NPD3022 Approved
0.8 Intermediate Similarity NPD1548 Phase 1
0.7956 Intermediate Similarity NPD4625 Phase 3
0.7933 Intermediate Similarity NPD1934 Approved
0.791 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7868 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7792 Intermediate Similarity NPD6234 Discontinued
0.7786 Intermediate Similarity NPD3620 Phase 2
0.7786 Intermediate Similarity NPD3619 Clinical (unspecified phase)
0.7785 Intermediate Similarity NPD1653 Approved
0.7778 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.777 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7769 Intermediate Similarity NPD6671 Approved
0.7763 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7717 Intermediate Similarity NPD4750 Phase 3
0.7708 Intermediate Similarity NPD3540 Phase 1
0.7697 Intermediate Similarity NPD37 Approved
0.7662 Intermediate Similarity NPD3882 Suspended
0.766 Intermediate Similarity NPD4060 Phase 1
0.766 Intermediate Similarity NPD1558 Phase 1
0.7639 Intermediate Similarity NPD3539 Phase 1
0.7635 Intermediate Similarity NPD1511 Approved
0.7619 Intermediate Similarity NPD5307 Clinical (unspecified phase)
0.7581 Intermediate Similarity NPD846 Approved
0.7581 Intermediate Similarity NPD940 Approved
0.7568 Intermediate Similarity NPD7124 Phase 2
0.7548 Intermediate Similarity NPD4966 Approved
0.7548 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7548 Intermediate Similarity NPD4965 Approved
0.7548 Intermediate Similarity NPD4967 Phase 2
0.7547 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7547 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7547 Intermediate Similarity NPD6166 Phase 2
0.7533 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7533 Intermediate Similarity NPD1512 Approved
0.7532 Intermediate Similarity NPD6232 Discontinued
0.75 Intermediate Similarity NPD3705 Approved
0.75 Intermediate Similarity NPD7975 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD1242 Phase 1
0.75 Intermediate Similarity NPD422 Phase 1
0.75 Intermediate Similarity NPD6111 Discontinued
0.75 Intermediate Similarity NPD7473 Discontinued
0.7483 Intermediate Similarity NPD5177 Phase 3
0.7468 Intermediate Similarity NPD7199 Phase 2
0.7466 Intermediate Similarity NPD2029 Clinical (unspecified phase)
0.7453 Intermediate Similarity NPD7228 Approved
0.7419 Intermediate Similarity NPD3020 Approved
0.7413 Intermediate Similarity NPD1240 Approved
0.7413 Intermediate Similarity NPD2238 Phase 2
0.7407 Intermediate Similarity NPD5844 Phase 1
0.7405 Intermediate Similarity NPD5494 Approved
0.74 Intermediate Similarity NPD4357 Discontinued
0.7397 Intermediate Similarity NPD2935 Discontinued
0.7397 Intermediate Similarity NPD6099 Approved
0.7397 Intermediate Similarity NPD6100 Approved
0.7394 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7388 Intermediate Similarity NPD5536 Phase 2
0.7386 Intermediate Similarity NPD4005 Discontinued
0.7375 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7372 Intermediate Similarity NPD3817 Phase 2
0.7365 Intermediate Similarity NPD6674 Discontinued
0.7365 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7364 Intermediate Similarity NPD2684 Approved
0.7362 Intermediate Similarity NPD7074 Phase 3
0.7346 Intermediate Similarity NPD3818 Discontinued
0.7344 Intermediate Similarity NPD968 Approved
0.7343 Intermediate Similarity NPD2674 Phase 3
0.7338 Intermediate Similarity NPD6696 Suspended
0.7338 Intermediate Similarity NPD4675 Approved
0.7338 Intermediate Similarity NPD4678 Approved
0.7333 Intermediate Similarity NPD7549 Discontinued
0.7319 Intermediate Similarity NPD2233 Approved
0.7319 Intermediate Similarity NPD2230 Approved
0.7319 Intermediate Similarity NPD2232 Approved
0.731 Intermediate Similarity NPD1607 Approved
0.7308 Intermediate Similarity NPD1465 Phase 2
0.7301 Intermediate Similarity NPD7054 Approved
0.7279 Intermediate Similarity NPD1357 Approved
0.7278 Intermediate Similarity NPD4055 Discovery
0.7273 Intermediate Similarity NPD5111 Phase 2
0.7273 Intermediate Similarity NPD5110 Phase 2
0.7273 Intermediate Similarity NPD3145 Approved
0.7273 Intermediate Similarity NPD3144 Approved
0.7273 Intermediate Similarity NPD7635 Approved
0.7273 Intermediate Similarity NPD5109 Approved
0.7267 Intermediate Similarity NPD2219 Phase 1
0.7256 Intermediate Similarity NPD7472 Approved
0.7248 Intermediate Similarity NPD3060 Approved
0.7246 Intermediate Similarity NPD1091 Approved
0.7239 Intermediate Similarity NPD7157 Approved
0.7237 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD7266 Discontinued
0.7229 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7226 Intermediate Similarity NPD4626 Approved
0.7226 Intermediate Similarity NPD4380 Phase 2
0.7222 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD8651 Approved
0.7211 Intermediate Similarity NPD6028 Clinical (unspecified phase)
0.7211 Intermediate Similarity NPD6029 Clinical (unspecified phase)
0.7211 Intermediate Similarity NPD1510 Phase 2
0.72 Intermediate Similarity NPD3892 Phase 2
0.7192 Intermediate Similarity NPD4097 Suspended
0.7181 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7177 Intermediate Similarity NPD2860 Approved
0.7177 Intermediate Similarity NPD2859 Approved
0.7172 Intermediate Similarity NPD943 Approved
0.7171 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7161 Intermediate Similarity NPD7261 Clinical (unspecified phase)
0.7154 Intermediate Similarity NPD290 Approved
0.7143 Intermediate Similarity NPD8053 Approved
0.7143 Intermediate Similarity NPD8054 Approved
0.7143 Intermediate Similarity NPD7843 Approved
0.7143 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD7447 Phase 1
0.7124 Intermediate Similarity NPD4160 Clinical (unspecified phase)
0.7123 Intermediate Similarity NPD230 Phase 1
0.7123 Intermediate Similarity NPD6355 Discontinued
0.7113 Intermediate Similarity NPD6584 Phase 3
0.7108 Intermediate Similarity NPD6797 Phase 2
0.7101 Intermediate Similarity NPD2667 Approved
0.7101 Intermediate Similarity NPD2668 Approved
0.7097 Intermediate Similarity NPD2933 Approved
0.7097 Intermediate Similarity NPD9296 Approved
0.7097 Intermediate Similarity NPD2934 Approved
0.7092 Intermediate Similarity NPD2922 Phase 1
0.7086 Intermediate Similarity NPD3750 Approved
0.7086 Intermediate Similarity NPD6331 Phase 2
0.7086 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD7095 Approved
0.7078 Intermediate Similarity NPD5261 Clinical (unspecified phase)
0.7071 Intermediate Similarity NPD1608 Approved
0.707 Intermediate Similarity NPD5089 Approved
0.707 Intermediate Similarity NPD5090 Approved
0.7066 Intermediate Similarity NPD7251 Discontinued
0.7063 Intermediate Similarity NPD9494 Approved
0.7059 Intermediate Similarity NPD7212 Phase 2
0.7059 Intermediate Similarity NPD7340 Approved
0.7059 Intermediate Similarity NPD7213 Phase 3
0.7051 Intermediate Similarity NPD6055 Clinical (unspecified phase)
0.705 Intermediate Similarity NPD3496 Discontinued
0.7045 Intermediate Similarity NPD5451 Approved
0.7044 Intermediate Similarity NPD6374 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD2797 Approved
0.7039 Intermediate Similarity NPD2677 Approved
0.7039 Intermediate Similarity NPD6190 Approved
0.7027 Intermediate Similarity NPD4536 Approved
0.7027 Intermediate Similarity NPD6895 Approved
0.7027 Intermediate Similarity NPD4538 Approved
0.7027 Intermediate Similarity NPD4537 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD6896 Approved
0.7024 Intermediate Similarity NPD7808 Phase 3
0.702 Intermediate Similarity NPD1652 Phase 2
0.702 Intermediate Similarity NPD4237 Approved
0.702 Intermediate Similarity NPD4236 Phase 3
0.7014 Intermediate Similarity NPD5752 Clinical (unspecified phase)
0.7013 Intermediate Similarity NPD4123 Phase 3
0.7013 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD5735 Approved
0.7007 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD5124 Phase 1
0.7006 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD6788 Approved
0.7 Intermediate Similarity NPD5762 Approved
0.7 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD1375 Discontinued
0.7 Intermediate Similarity NPD5763 Approved
0.7 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.6993 Remote Similarity NPD4624 Approved
0.6986 Remote Similarity NPD6233 Phase 2
0.6985 Remote Similarity NPD709 Approved
0.6984 Remote Similarity NPD288 Approved
0.6981 Remote Similarity NPD2977 Approved
0.6981 Remote Similarity NPD2978 Approved
0.6978 Remote Similarity NPD6516 Phase 2
0.6978 Remote Similarity NPD5846 Approved
0.6974 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6974 Remote Similarity NPD7466 Approved
0.6974 Remote Similarity NPD4110 Phase 3
0.6972 Remote Similarity NPD1283 Approved
0.6964 Remote Similarity NPD7240 Approved
0.6963 Remote Similarity NPD1398 Phase 1

Structure

External Identifiers

PubChem CID   44559636
ChEMBL   CHEMBL451345
ZINC  

Physicochemical Properties

Molecular Weight:  270.13
ALogP:  0.1421
MLogP:  3
XLogP:  5.24
# Rotatable Bonds:  8
Polar Surface Area:  38.69
# H-Bond Aceptor:  0
# H-Bond Donor:  1
# Rings:  2
# Heavy Atoms:  20

Download Data

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