Adenine

Adenine

SCHEMBL16485900

Nc1ncnc2[nH]cnc12.O=C(O)/C=C/C(=O)O

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 0.37
PI4K2B Q8TCG2 2/20 0.37
PI4K2A Q9BTU6 2/20 0.37
PI4KB Q9UBF8 2/20 0.37
LMNA P02545 1/20 0.37
DRD3 P35462 1/20 0.37
XDH P47989 1/20 0.37
LRRK2 Q5S007 1/20 0.37
GDA Q9Y2T3 1/20 0.37
KDM4E B2RXH2 1/20 0.34
BLM P54132 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
MAP3K7 O43318 1/20 0.34
TAB1 Q15750 1/20 0.34
ALDH1A1 P00352 1/20 0.33
HIF1A Q16665 1/20 0.32
AHCY P23526 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32

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 SCHEMBL16485906 1.00 PI4KA (0.37) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL385841 0.88 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL14125907 0.86 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL28763031 0.86 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL9621204 0.86 GDA (0.46) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL8110 0.84 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL3413247 0.84 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL3416954 0.84 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL3414603 0.84 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBLMNA
Adenine SCHEMBL28113159 0.83 APEX1 (0.40) 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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106536532-B Tenofovir prodrug novel polymorphic and its preparation method and application 江苏豪森药业集团有限公司 2019-09-03 CN claimed
CN-110146639-A A kind of analysis method of the novel nucleoside acids reverse transcriptase inhibitor in relation to substance 南京正大天晴制药有限公司 2019-08-20 CN claimed
CN-106536532-A New polycrystalline form of tenofovir prodrug, and preparation method and application therefor 江苏豪森药业集团有限公司 2017-03-22 CN claimed
CN-105399771-A Crystal form of tenofovir prodrug, preparation method and application of crystal form JIANGSU HANSOH PHARMACEUTICAL GROUP LIANYUNGANG HONGCHUANG PHARMACEUTICAL CO LTD 2016-03-16 CN claimed
CN-101193642-A Nucleotide analog prodrug and preparation thereof BORUI BIOLOG MEDICAL TECHNOLOG (CN) 2008-06-04 CN claimed
US-20240415838-A1 USE OF TREM-1 INHIBITORS FOR TREATMENT, ELIMINATION AND ERADICATION OF HIV-1 INFECTION UNIV EMORY (US) 2024-12-19 US disclosed
CN-117624242-A Purification method of tenofovir alafenamide intermediate 上海迪赛诺化学制药有限公司 2024-03-01 CN disclosed
CN-117510542-A Ai Miti norfovir fumarate spherical crystal and preparation method thereof 天津大学 2024-02-06 CN disclosed
CN-114591367-B Continuous production method of tenofovir disoproxil fumarate 安徽贝克制药股份有限公司 2023-12-08 CN disclosed
CN-113583048-B Tenofovir Wei Linsuan ester c crystal form and preparation and application thereof 西安新通药物研究股份有限公司 2023-09-01 CN disclosed
CN-113683641-B Tenofovir Wei Linsuan ester d crystal form and preparation and application thereof 西安新通药物研究股份有限公司 2023-09-01 CN disclosed
CN-113583050-B Tenofovir Wei Linsuan ester a crystal form and preparation and application thereof 西安新通药物研究股份有限公司 2023-09-01 CN disclosed
CN-103211826-A Antiviral pharmaceutical composition as well as preparation method and application thereof FUJIAN COSUNTER PHARMACEUTICAL CO LTD 2013-07-24 CN disclosed
CN-102670629-A Compositions and methods for combination antiviral therapy GILEAD SCIENCES INC 2012-09-19 CN disclosed
CN-1738628-B Compositions and methods for combination antiviral therapy GILEAD SCIENCES INC 2012-06-06 CN disclosed
CN-101878032-A Potent combination of zidovudine and agents selected against the K65R mutation in HIV polymerase RFS PHARMA LLC 2010-11-03 CN disclosed
CN-101574356-A Tenofovir disoproxil pharmaceutical salt and preparations thereof HEILONGJIANG CALIFORNIA INTERN (CN) 2009-11-11 CN disclosed
CN-101066981-A Non-cyclic nucleoside phosphonate compound and its composition, prepn process and use SHANGHAI INST OF MEDICINES CAS (CN) 2007-11-07 CN disclosed
CN-1938017-A Therapeutic combinations AGOURON PHARMA (US) 2007-03-28 CN disclosed
CN-1738628-A Compositions and methods for combination antiviral therapy GILEAD SCIENCES INC (US) 2006-02-22 CN 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 (1 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-20240415838-A1 USE OF TREM-1 INHIBITORS FOR TREATMENT, ELIMINATION AND ERADICATION OF HIV-1 INFECTION MERTK, PNP, HAVCR2 PI4KA 459/4885PI4K2B 1454/4885PI4K2A 963/4885

“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.