Drug Information

Drug ID:  NPD1527
Drug Name:  Cridanimod
Molecular Formula:  C15H11NO3
Canonical SMILES:  OC(=O)Cn1c2ccccc2c(=O)c2c1cccc2
Standard InCHI:  InChI=1S/C15H11NO3/c17-14(18)9-16-12-7-3-1-5-10(12)15(19)11-6-2-4-8-13(11)16/h1-8H,9H2,(H,17,18)
Standard InCHIKey:  UOMKBIIXHQIERR-UHFFFAOYSA-N
Max Developmental Stage:  Phase 2
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD1527

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
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Similarity Level Similarity Score Natural Product ID
High Similarity 0.8594 NPC268534
High Similarity 0.8516 NPC257490
Intermediate Similarity 0.8421 NPC194562
Intermediate Similarity 0.8217 NPC291962
Intermediate Similarity 0.8217 NPC177684
Intermediate Similarity 0.8154 NPC161956
Intermediate Similarity 0.8154 NPC258531
Intermediate Similarity 0.8154 NPC112373
Intermediate Similarity 0.7941 NPC209389
Intermediate Similarity 0.7895 NPC39818
Intermediate Similarity 0.7852 NPC470343
Intermediate Similarity 0.7852 NPC472244
Intermediate Similarity 0.7832 NPC43477
Intermediate Similarity 0.7832 NPC471574
Intermediate Similarity 0.7803 NPC226143
Intermediate Similarity 0.7778 NPC192533
Intermediate Similarity 0.7744 NPC279385
Intermediate Similarity 0.7744 NPC179605
Intermediate Similarity 0.7704 NPC254698
Intermediate Similarity 0.7687 NPC103292
Intermediate Similarity 0.7671 NPC136002
Intermediate Similarity 0.7671 NPC130797
Intermediate Similarity 0.7639 NPC207554
Intermediate Similarity 0.7609 NPC58827
Intermediate Similarity 0.7609 NPC72473
Intermediate Similarity 0.7609 NPC307437
Intermediate Similarity 0.7536 NPC322433
Intermediate Similarity 0.7484 NPC318183
Intermediate Similarity 0.7483 NPC300299
Intermediate Similarity 0.7422 NPC172170
Intermediate Similarity 0.7417 NPC144691
Intermediate Similarity 0.7413 NPC253476
Intermediate Similarity 0.7389 NPC204867
Intermediate Similarity 0.7347 NPC471164
Intermediate Similarity 0.7305 NPC150863
Intermediate Similarity 0.7266 NPC167336
Intermediate Similarity 0.7254 NPC472245
Intermediate Similarity 0.7254 NPC280807
Intermediate Similarity 0.7254 NPC314431
Intermediate Similarity 0.7237 NPC300596
Intermediate Similarity 0.7237 NPC237649
Intermediate Similarity 0.7229 NPC470317
Intermediate Similarity 0.7219 NPC478039
Intermediate Similarity 0.7218 NPC57051
Intermediate Similarity 0.7205 NPC472118
Intermediate Similarity 0.72 NPC314186
Intermediate Similarity 0.719 NPC13526
Intermediate Similarity 0.7188 NPC182131
Intermediate Similarity 0.7178 NPC470548
Intermediate Similarity 0.717 NPC138293
Intermediate Similarity 0.717 NPC113056
Intermediate Similarity 0.7152 NPC475094
Intermediate Similarity 0.7143 NPC122553
Intermediate Similarity 0.7123 NPC173295
Intermediate Similarity 0.7095 NPC83214
Intermediate Similarity 0.7086 NPC470822
Intermediate Similarity 0.7083 NPC314098
Intermediate Similarity 0.7055 NPC316104
Intermediate Similarity 0.7055 NPC162417
Intermediate Similarity 0.7051 NPC295021
Intermediate Similarity 0.7044 NPC27904
Intermediate Similarity 0.7037 NPC70949
Intermediate Similarity 0.703 NPC471743
Intermediate Similarity 0.7014 NPC477432
Intermediate Similarity 0.7006 NPC475685
Intermediate Similarity 0.7 NPC2823
Intermediate Similarity 0.7 NPC470301
Remote Similarity 0.6993 NPC324445
Remote Similarity 0.6987 NPC117032
Remote Similarity 0.6977 NPC313293
Remote Similarity 0.6966 NPC316746
Remote Similarity 0.6957 NPC189116
Remote Similarity 0.6951 NPC292265
Remote Similarity 0.6937 NPC322644
Remote Similarity 0.6933 NPC315051
Remote Similarity 0.6918 NPC207428
Remote Similarity 0.6909 NPC177261
Remote Similarity 0.6905 NPC298320
Remote Similarity 0.6867 NPC469560
Remote Similarity 0.6857 NPC130931
Remote Similarity 0.6848 NPC355
Remote Similarity 0.6832 NPC93653
Remote Similarity 0.6821 NPC472243
Remote Similarity 0.6815 NPC314223
Remote Similarity 0.6797 NPC478040
Remote Similarity 0.6784 NPC471742
Remote Similarity 0.678 NPC472116
Remote Similarity 0.677 NPC36495
Remote Similarity 0.6769 NPC291610
Remote Similarity 0.6768 NPC472115
Remote Similarity 0.6768 NPC472114
Remote Similarity 0.6766 NPC475594
Remote Similarity 0.6752 NPC473329
Remote Similarity 0.6742 NPC476198
Remote Similarity 0.6726 NPC475607
Remote Similarity 0.6709 NPC154602
Remote Similarity 0.6707 NPC299582
Remote Similarity 0.6707 NPC252572
Remote Similarity 0.6706 NPC73994
Remote Similarity 0.6689 NPC40364
Remote Similarity 0.6687 NPC471943
Remote Similarity 0.6687 NPC199737
Remote Similarity 0.6687 NPC88970
Remote Similarity 0.6686 NPC157583
Remote Similarity 0.6686 NPC474081
Remote Similarity 0.6685 NPC472539
Remote Similarity 0.6685 NPC470787
Remote Similarity 0.6685 NPC472540
Remote Similarity 0.6667 NPC187231
Remote Similarity 0.6667 NPC226794
Remote Similarity 0.6667 NPC316202
Remote Similarity 0.6667 NPC154478
Remote Similarity 0.6648 NPC472542
Remote Similarity 0.6648 NPC472541
Remote Similarity 0.6647 NPC133003
Remote Similarity 0.6647 NPC474041
Remote Similarity 0.6647 NPC475761
Remote Similarity 0.6646 NPC265100
Remote Similarity 0.6646 NPC84317
Remote Similarity 0.6627 NPC167724
Remote Similarity 0.6627 NPC224970
Remote Similarity 0.6627 NPC223595
Remote Similarity 0.6626 NPC474058
Remote Similarity 0.6623 NPC471123
Remote Similarity 0.6623 NPC472241
Remote Similarity 0.6606 NPC471130
Remote Similarity 0.6606 NPC115232
Remote Similarity 0.6605 NPC213914
Remote Similarity 0.6605 NPC61013
Remote Similarity 0.6601 NPC130251
Remote Similarity 0.6599 NPC122235
Remote Similarity 0.6593 NPC302790
Remote Similarity 0.6591 NPC324091
Remote Similarity 0.659 NPC207851
Remote Similarity 0.6588 NPC284775
Remote Similarity 0.6588 NPC219848
Remote Similarity 0.6585 NPC293458
Remote Similarity 0.6584 NPC209362
Remote Similarity 0.6581 NPC314287
Remote Similarity 0.6577 NPC53044
Remote Similarity 0.6571 NPC473815
Remote Similarity 0.6566 NPC41717
Remote Similarity 0.6564 NPC193410
Remote Similarity 0.6564 NPC80681
Remote Similarity 0.6561 NPC259678
Remote Similarity 0.6561 NPC470579
Remote Similarity 0.6552 NPC285394
Remote Similarity 0.655 NPC256268
Remote Similarity 0.6532 NPC243058
Remote Similarity 0.6529 NPC151635
Remote Similarity 0.6524 NPC248117
Remote Similarity 0.6522 NPC478076
Remote Similarity 0.6522 NPC251391
Remote Similarity 0.6519 NPC474916
Remote Similarity 0.6517 NPC114039
Remote Similarity 0.6517 NPC206109
Remote Similarity 0.6512 NPC85613
Remote Similarity 0.6503 NPC27833
Remote Similarity 0.65 NPC102592
Remote Similarity 0.65 NPC66936
Remote Similarity 0.65 NPC79356
Remote Similarity 0.65 NPC243756
Remote Similarity 0.6497 NPC472242
Remote Similarity 0.6494 NPC242933
Remote Similarity 0.6494 NPC203635
Remote Similarity 0.6491 NPC237188
Remote Similarity 0.6485 NPC242116
Remote Similarity 0.6485 NPC476231
Remote Similarity 0.6478 NPC105811
Remote Similarity 0.6474 NPC191415
Remote Similarity 0.6471 NPC287358
Remote Similarity 0.6471 NPC469529
Remote Similarity 0.6467 NPC114637
Remote Similarity 0.6463 NPC471122
Remote Similarity 0.646 NPC70406
Remote Similarity 0.646 NPC470679
Remote Similarity 0.646 NPC217021
Remote Similarity 0.646 NPC285381
Remote Similarity 0.6456 NPC467188
Remote Similarity 0.6453 NPC474815
Remote Similarity 0.6452 NPC186284
Remote Similarity 0.6452 NPC22082
Remote Similarity 0.645 NPC112336
Remote Similarity 0.645 NPC474814
Remote Similarity 0.6443 NPC179224
Remote Similarity 0.6438 NPC241392
Remote Similarity 0.6437 NPC159125
Remote Similarity 0.6429 NPC470894
Remote Similarity 0.6429 NPC319645
Remote Similarity 0.6424 NPC225319
Remote Similarity 0.642 NPC90415
Remote Similarity 0.642 NPC312860
Remote Similarity 0.642 NPC281094
Remote Similarity 0.6416 NPC5167
Remote Similarity 0.6413 NPC471944
Remote Similarity 0.6412 NPC322598
Remote Similarity 0.6409 NPC170333
Remote Similarity 0.6402 NPC123241
Remote Similarity 0.6402 NPC113946
Remote Similarity 0.6402 NPC104345

Drug Structure

External Identifiers

TTD  
DrugBank  
ChEMBL  
IUPHAR/BPS  
PharmaGKB  
KEGG Drug  
PubChem CID  
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  253.07
ALogP  -0.6922
MLogP  2.67
XLogP  3.35
HDA  4
HBD  1
Rotatable Bonds  3
TPSA  57.61
RO5 Violation  0