Adenine

Adenine

SCHEMBL502574

NC(=O)c1ccccc1.Nc1ncnc2[nH]cnc12

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
CYP2C19 P33261 1/20 0.47
RECQL P46063 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MKNK1 Q9BUB5 3/20 0.42
EGFR P00533 2/20 0.42
MAP4K4 O95819 3/20 0.41
BRD4 O60885 1/20 0.41
CDC7 O00311 2/20 0.41
ROCK2 O75116 2/20 0.41
PIM1 P11309 2/20 0.41
CDK2 P24941 2/20 0.41

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 SCHEMBL23629791 0.87 MKNK1 (0.41) PARP1CYP3A4CYP2C19MKNK1MAP4K4
Adenine SCHEMBL15699 0.85 F7 (0.56) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL22748483 0.85 F7 (0.56) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL2564207 0.85 F7 (0.56) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL8414752 0.85 F7 (0.52) PARP1MKNK1EGFRROCK2PIM1
Adenine SCHEMBL9621204 0.84 GDA (0.46) PARP1MKNK1MAP4K4GSK3BGDA
Adenine SCHEMBL23859925 0.84 F7 (0.55) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL22129922 0.84 F7 (0.55) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL23531099 0.84 F7 (0.55) PARP1MKNK1EGFRPIM1CDK2
Adenine SCHEMBL7712105 0.84 F7 (0.55) PARP1POLBMKNK1EGFRPIM1

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 78 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-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
WO-2023288002-A1 PHTHALAZINONE-BASED PARP-1 INHIBITORS OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-19 WO disclosed
EP-1366055-A2 ANTIVIRAL AGENTS FOR TREATMENT OF FLAVIVIRIDAE INFECTIONS Pharmasset Limited (BB) 2003-12-03 EP 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 PARP1 95/4885POLB 1634/4885CYP3A4 395/4885
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 PARP1 1941/4885POLB 1568/4885CYP3A4 731/4885
US-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT SARM1, PARP16, NAMPT PARP1 40/4885POLB 2017/4885CYP3A4 4150/4885
US-11633414-B2 Nicotinoyl riboside compositions and methods of use NNT, CD38, NAMPT PARP1 62/4885POLB 3419/4885CYP3A4 4586/4885
US-20040266723-A1 Antiviral agents for treatment of Flaviviridae infections HAVCR2, MAVS, EIF2AK2 PARP1 2737/4885POLB 2211/4885CYP3A4 194/4885

“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.