Adenine

Adenine

SCHEMBL6388001

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

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

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 4/20 0.39
PI4K2B Q8TCG2 4/20 0.39
PI4K2A Q9BTU6 4/20 0.39
PI4KB Q9UBF8 4/20 0.39
XDH P47989 2/20 0.39
LRRK2 Q5S007 2/20 0.39
LMNA P02545 1/20 0.39
DRD3 P35462 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GDA Q9Y2T3 1/20 0.35
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PNP P00491 1/20 0.32
RET P07949 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 SCHEMBL27773964 1.00 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL40370 0.98 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL27690901 0.98 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL8426316 0.96 PI4KA (0.42) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL5663794 0.93 CYP1A2 (0.43) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL2772644 0.89 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL2895675 0.89 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL10790458 0.88 NOTUM (0.34) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL18260155 0.87 PI4KA (0.35) PI4KAPI4K2BPI4K2API4KBXDH
Adenine SCHEMBL2428538 0.87 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBXDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1268350-C Medicinal compositions for promoting recovery from stress loading and novel matsutake mushroom strain KUREHA CHEMICAL IND CO LTD (JP) 2006-08-09 CN disclosed
US-20050180991-A1 Hypotensive agent and food KUREHA CORPORATION (JP) 2005-08-18 US disclosed
US-20050180990-A1 Antidiabetic agent and food KUREHA CORPORATION (JP) 2005-08-18 US disclosed
US-20050147619-A1 Anion exchange resin adsorbed fraction immunopotentiator and promoter for recovery from loaded stress originating in matsutake mushroom KUREHA CORPORATION (JP) 2005-07-07 US disclosed
EP-1477179-A1 ANION EXCHANGE RESIN ADSORBED FRACTION, IMMUNOPOTENTIATOR AND PROMOTER FOR RECOVERY FROM LOADED STRESS ORIGINATING IN MATSUTAKE MUSHROOM Kureha Chemical Industry Co., Ltd. (JP) 2004-11-17 EP disclosed
US-20040126393-A1 Infection preventive or therapeutic agent and food KUREHA CORPORATION (JP) 2004-07-01 US disclosed
US-20040126392-A1 Cancer preventive agent and food KUREHA CHEMICAL INDUSTRY COMPANY, LIMITED (JP) 2004-07-01 US disclosed
CN-1469751-A Medicinal composition for promoting recovery from stress load and novel matsutake mushroom strain ��Ԩ��ѧ��ҵ��ʽ���� 2004-01-21 CN disclosed
US-20030180901-A1 Medicinal compositions for promoting recovery from stress loading and novel matsutake mushroom strain KUREHA CORPORATION (JP) 2003-09-25 US disclosed
EP-1331009-A1 MEDICINAL COMPOSITIONS FOR PROMOTING RECOVERY FROM STRESS LOADING AND NOVEL MATSUTAKE MUSHROOM STRAIN Kureha Chemical Industry Co., Ltd. (JP) 2003-07-30 EP disclosed
US-6570068-B1 Generation of transgentic crop plant; obtain plant tissue, incubate with exogenous nucleotide sequences in microparticle, transform plant with particle bombardment, recover transformed plant MISSISSIPPI STATE UNIVERSITY 2003-05-27 US disclosed
US-6140555-A PRECIPITATING DNA ONTO TUNGSTEN MICROPROJECTILES OF ABOUT 1.4-1.8 MICRON AVERAGE SIZE AND HAVING ABOUT 0.75 TO 1.25 MICROGRAMS OF DNA PER 720 MICORGRAMS OF TUNGSTEN; BOMBARDING BY ACCELERATING AT A HIGH PRESSURE FROM 7.25 CENTIMETERS MISSISSIPPI STATE UNIVERSITY (US) 2000-10-31 US disclosed
WO-1997029873-A1 METHOD OF MAKING MOULDS AND CORES USING A BINDING AGENT CAPABLE OF REVERSIBLE PHASE CONVERSION BETWEEN THE SOLID AND THE LIQUID STATE GEORG FISCHER DISA A/S (DK) 1997-08-21 WO disclosed