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ChEMBL

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ChEMBL Statistics
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UniChem Connectivity Layer Cross References

Legend

Letters 's', 'i' and 'p' describe how structures differ from structure with InChI Key SGUAFYQXFOLMHL-UHFFFAOYSA-N

  • s = stereochemical difference.
  • i = isotopic difference.
  • p = protonation differences identified.



Source Identical Component s i p si ip sp sip
ChEMBL CHEMBL429 CHEMBL1200323 CHEMBL1204165 CHEMBL28140 CHEMBL1202514 CHEMBL1202510 CHEMBL1204174 CHEMBL28308 CHEMBL27193 CHEMBL28681
DrugBank DB00598
Guide to Pharmacology 7207
PubChem: Drugs of the Future 12013434 12013100
KEGG Ligand C07063
ChEBI 6343 6344 94471
NIH Clinical Collection SAM002564217
ZINC ZINC000000403010 ZINC000000004319 ZINC000000403011 ZINC000000000416
eMolecules 653717 539867 29936179
IBM Patent System 1D4E58673678E1F5AC6D368DD3531490 DDC6EC441223E680F51B4DF9D6345279 A401A8EDDD45E374E195D28E8F6E367B
Atlas labetalol
FDA SRS O5OBT75D2C P6629XE33T
SureChEMBL SCHEMBL7101128 SCHEMBL7776431 SCHEMBL10350785 SCHEMBL4946286 SCHEMBL10350784 SCHEMBL8746432 SCHEMBL8358640 SCHEMBL8741251 SCHEMBL3231463 SCHEMBL1770432 SCHEMBL9837906 SCHEMBL9837504 SCHEMBL6194558 SCHEMBL2807355 SCHEMBL14894885 SCHEMBL4667366 SCHEMBL8894018 SCHEMBL9741795 SCHEMBL1670716 SCHEMBL888086 SCHEMBL9551672 SCHEMBL6383244 SCHEMBL296360 SCHEMBL19207977 SCHEMBL5885719 SCHEMBL1832956 SCHEMBL41230 SCHEMBL10863742 SCHEMBL7617525 SCHEMBL19815736 SCHEMBL5457897 SCHEMBL8399198 SCHEMBL4582 SCHEMBL2475769 SCHEMBL8212295 SCHEMBL9614383 SCHEMBL3137278 SCHEMBL16095516 SCHEMBL9837071 SCHEMBL9937575 SCHEMBL8746432 SCHEMBL10356800 SCHEMBL6944753 SCHEMBL10882744 SCHEMBL7273474 SCHEMBL588720 SCHEMBL5817378 SCHEMBL9715689 SCHEMBL10450118 SCHEMBL79468 SCHEMBL41231
PharmGKB PA164743150
Human Metabolome Database HMDB0014736
PubChem: Thomson Pharma 14777379 14877053 14779267 15445877 14850919
PubChem 88598109 87753144 88200384 69989137 66830943 67680043 67155229 67938570 22295547 67542420 69136440 67116032 12595692 45114126 67876265 67422408 66646258 24847769 69596696 85364157 71412 657196 130299427 134210404 88265154 3869 67938378 90457278 69449454 67973931 90477511 3046034 53299 12595691 70349571 12595696 69943961 636407 50986662 134043 12595694 69579376 53300 134044 3046033 12595690 134045 118988635 129010203 24848330 71749708 41097887 25271867 25271683 41097888
Mcule MCULE-6427232261 MCULE-1213322446
LINCS LSM-1282 LSM-5220
ACToR 36894-69-6 32780-64-6 72487-35-5 75659-08-4 72487-31-1 61466-93-1 83167-31-1 83167-24-2 72487-32-2 75659-07-3 83167-32-2
MolPort MolPort-003-898-140 MolPort-003-666-813
Nikkaji J19.703C J291.363A J23.747G J291.365H J291.364J
BindingDB 25758
EPA CompTox Dashboard DTXSID2023191 DTXSID0044654 DTXSID90222779 DTXSID7020477 DTXSID2043828
DrugCentral 1531 894
Brenda 25983
ChemicalBook CB8334888

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/key_search/SGUAFYQXFOLMHL-UHFFFAOYSA-N/0/0/4
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