Adenine

Adenine

SCHEMBL502575

NC(=O)c1ccccc1.Nc1ncnc2nc[nH]c12

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.63
PI4KA P42356 2/20 0.63
PI4K2B Q8TCG2 2/20 0.63
PI4K2A Q9BTU6 2/20 0.63
PI4KB Q9UBF8 2/20 0.63
DRD3 P35462 1/20 0.63
XDH P47989 1/20 0.63
LRRK2 Q5S007 1/20 0.63
MKNK1 Q9BUB5 1/20 0.56
BRD4 O60885 1/20 0.56
ALDH1A1 P00352 2/20 0.52
CYP1A2 P05177 2/20 0.52
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HIF1A Q16665 1/20 0.52
NT5C2 P49902 2/20 0.49
NT5E P21589 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Adenine SCHEMBL2564210 0.85 PI4KA (0.55) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL22748487 0.85 PI4KA (0.55) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL15700 0.85 PI4KA (0.55) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL8414755 0.85 PI4KA (0.51) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL9621210 0.85 PI4KA (0.81) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL23531102 0.84 PI4KA (0.54) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL11807683 0.84 PI4KA (0.54) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL1324561 0.84 PI4KA (0.54) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL27518288 0.84 PI4KA (0.54) LMNAPI4KAPI4K2BPI4K2API4KB
Adenine SCHEMBL7712108 0.84 PI4KA (0.54) LMNAPI4KAPI4K2BPI4K2API4KB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 91 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT UNIV OREGON HEALTH & SCIENCE (US) 2023-07-06 US claimed
WO-2021262548-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-12-30 WO claimed
US-20180258464-A1 METHODS FOR THE DESIGN OF MECHANISM-BASED SIRTUIN ACTIVATING COMPOUNDS CHAKRABARTI ADVANCED TECHNOLOGY LLC 2018-09-13 US claimed
WO-2017048836-A1 METHODS FOR THE DESIGN OF MECHANISM-BASED SIRTUIN ACTIVATING COMPOUNDS PMC ADVANCED TECHNOLOGY LLC (US) 2017-03-23 WO claimed
US-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections PHARMASSET, INC. 2004-12-30 US claimed
CN-1527836-A Antiviral agents for treatment of flaviviridae infections 2004-09-08 CN claimed
EP-1366055-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS Pharmasset Limited (BB) 2003-12-03 EP claimed
WO-2002048165-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS PHARMASSET LTD. (BB) 2002-06-20 WO claimed
EP-4370125-A1 PHTHALAZINONE-BASED PARP-1 INHIBITORS Oregon Health and Science University (US) 2024-05-22 EP disclosed
WO-2024013349-A1 BENZAMIDE ADENINE DINUCLEOSIDE COMPOUNDS AND THEIR USES Institut National de la Santé et de la Recherche Médicale (FR) 2024-01-18 WO disclosed
WO-2024013349-A1 BENZAMIDE ADENINE DINUCLEOSIDE COMPOUNDS AND THEIR USES Institut National de la Santé et de la Recherche Médicale (FR) 2024-01-18 WO disclosed
US-11834470-B2 4-thioribose NAD analogues and methods of synthesizing and using the same UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2023-12-05 US disclosed
US-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT UNIV OREGON HEALTH & SCIENCE (US) 2023-07-06 US disclosed
US-11633414-B2 Nicotinoyl riboside compositions and methods of use CORNELL UNIVERSITY (US) 2023-04-25 US disclosed
EP-1349562-A2 INHIBITING GS-FDH TO MODULATE NO BIOACTIVITY Duke University (US) 2003-10-08 EP disclosed
US-20030148966-A1 Method and composition for inducing apoptosis in cells ADVANCED RESEARCH & TECHNOLOGY INSTITUTE OF INDIANA UNIVERSITY 2003-08-07 US disclosed
US-20020128205-A1 Modulating nitric oxide acitivity with glutathione-dependent formaldehyde dehydrogenase (GS-FDH); for treatment of asthma and impotency, angina, hypertension, and cancer; enzyme inhibitors DUKE UNIVERSITY OFFICE OF SCIENCE AND TECHNOLOGY (US) 2002-09-12 US disclosed
WO-2002055018-A2 INHIBITING GS-FDH TO MODULATE NO BIOACTIVITY DUKE UNIVERSITY (US) 2002-07-18 WO disclosed
WO-2002048165-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS PHARMASSET LTD. (BB) 2002-06-20 WO disclosed
US-5902792-A Method of inducing apoptosis in cancer cells ADVANCED RESEARCH & TECHNOLOGY INSTITUTE (US) 1999-05-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11834470-B2 4-thioribose NAD analogues and methods of synthesizing and using the same CD38, NQO1, NADK LMNA 2720/4885PI4KA 3664/4885PI4K2B 3669/4885
US-20020128205-A1 Modulating nitric oxide acitivity with glutathione-dependent formaldehyde dehydrogenase (GS-FDH); for treatment of asthma and impotency, angina, hypertension, and cancer; enzyme inhibitors GGH, GSS, GSR LMNA 4362/4885PI4KA 4247/4885PI4K2B 4529/4885
US-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT SARM1, PARP16, NAMPT LMNA 992/4885PI4KA 3648/4885PI4K2B 3024/4885
US-11633414-B2 Nicotinoyl riboside compositions and methods of use NNT, CD38, NAMPT LMNA 871/4885PI4KA 3474/4885PI4K2B 3871/4885
US-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections HAVCR2, MAVS, EIF2AK2 LMNA 4363/4885PI4KA 672/4885PI4K2B 969/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.