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