Adenine

Adenine

SCHEMBL14125907

CC(=O)O.Nc1ncnc2[nH]cnc12

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Adenine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.39
PI4K2B Q8TCG2 2/20 0.39
PI4K2A Q9BTU6 2/20 0.39
PI4KB Q9UBF8 2/20 0.39
LMNA P02545 1/20 0.39
DRD3 P35462 1/20 0.39
XDH P47989 1/20 0.39
LRRK2 Q5S007 1/20 0.39
GDA Q9Y2T3 1/20 0.39
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
MAP4K4 O95819 4/20 0.35
ALDH1A1 P00352 1/20 0.34
GSK3B P49841 1/20 0.33
PARP1 P09874 1/20 0.33
BRAF P15056 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EGFR P00533 1/20 0.33
TSHR P16473 1/20 0.33
AHCY P23526 1/20 0.33

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 SCHEMBL385841 0.91 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL9621204 0.89 GDA (0.46) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL1871837 0.89 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL3413247 0.87 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL3416954 0.87 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL8110 0.87 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL16485900 0.86 PI4KA (0.37) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL16485906 0.86 PI4KA (0.37) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL5663794 0.86 CYP1A2 (0.43) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL9952923 0.85 MTAP (0.39) PI4KAPI4K2BPI4K2API4KBLMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119039583-B Side-chain base biodegradable polyester amide with stereocomplex crystallization performance and enzymatic preparation method thereof 浙江农林大学 2025-03-11 CN claimed
CN-119039583-A Side-chain base biodegradable polyester amide with stereocomplex crystallization performance and enzymatic preparation method thereof 浙江农林大学 2024-11-29 CN claimed
CN-119039583-B Side-chain base biodegradable polyester amide with stereocomplex crystallization performance and enzymatic preparation method thereof 浙江农林大学 2025-03-11 CN disclosed
CN-119039583-A Side-chain base biodegradable polyester amide with stereocomplex crystallization performance and enzymatic preparation method thereof 浙江农林大学 2024-11-29 CN disclosed
US-10093674-B2 Supramolecular nanofibers and hydrogels based on nucleic acids functionalized with nucleobases BRANDEIS UNIVERSITY (US) 2018-10-09 US disclosed
US-20180100036-A1 CLICK NUCLEIC ACID POLYMERS AND METHODS OF USE UNIV COLORADO REGENTS (US) 2018-04-12 US disclosed
US-20140148410-A1 Supramolecular Nanofibers and Hydrogels Based on Nucleic Acids Functionalized with Nucleobases BRANDEIS UNIVERSITY (US) 2014-05-29 US disclosed
WO-2012166705-A2 SUPRAMOLECULAR NANOFIBERS AND HYDROGELS BASED ON AMINO ACID-NUCLEOBASE-GLYCOSIDE CONJUGATES BRANDEIS UNIVERSITY (US) 2012-12-06 WO disclosed
WO-2012166706-A2 SUPRAMOLECULAR NANOFIBERS AND HYDROGELS BASED ON OLIGOPEPTIDES FUNCTIONALIZED WITH NUCLEOBASES BRANDEIS UNIVERSITY (US) 2012-12-06 WO 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 (2 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-20140148410-A1 Supramolecular Nanofibers and Hydrogels Based on Nucleic Acids Functionalized with Nucleobases PHAX, PCNA, RBM28 PI4KA 3415/4885PI4K2B 3725/4885PI4K2A 3501/4885
US-10093674-B2 Supramolecular nanofibers and hydrogels based on nucleic acids functionalized with nucleobases PHAX, PCNA, RBM28 PI4KA 3415/4885PI4K2B 3725/4885PI4K2A 3501/4885

“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.