Adenine

Adenine

SCHEMBL11022893

NC(=[Se])c1cccnc1.Nc1ncnc2[nH]cnc12

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ F7 P08709 1/20 0.40
▸ F3 P13726 1/20 0.40
▸ SARM1 Q6SZW1 1/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ SIRT6 Q8N6T7 1/20 0.40
▸ SIRT1 Q96EB6 1/20 0.40
▸ SIRT3 Q9NTG7 1/20 0.40
▸ SIRT5 Q9NXA8 1/20 0.40
▸ SIRT4 Q9Y6E7 1/20 0.40
▸ PI4KA P42356 1/20 0.39
▸ PI4K2B Q8TCG2 1/20 0.39
▸ PI4K2A Q9BTU6 1/20 0.39
▸ PI4KB Q9UBF8 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ POLB P06746 1/20 0.36
▸ HDAC1 Q13547 2/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35

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 SCHEMBL622425 0.88 EGFR (0.42) EGFRSRCKDRF7F3
Adenine SCHEMBL22748483 0.88 F7 (0.56) EGFRSRCKDRF7F3
Adenine SCHEMBL15699 0.88 F7 (0.56) EGFRSRCKDRF7F3
Adenine SCHEMBL2564207 0.88 F7 (0.56) EGFRSRCKDRF7F3
Adenine SCHEMBL23859925 0.87 F7 (0.55) EGFRSRCKDRF7F3
Adenine SCHEMBL7712105 0.87 F7 (0.55) EGFRSRCKDRF7F3
Adenine SCHEMBL22129922 0.87 F7 (0.55) EGFRSRCKDRF7F3
Adenine SCHEMBL28614873 0.87 F7 (0.55) EGFRSRCKDRF7F3
Adenine SCHEMBL23531099 0.87 F7 (0.55) EGFRSRCKDRF7F3
Adenine SCHEMBL11807677 0.87 F7 (0.55) EGFRSRCKDRF7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906639-B2 Method of determining factor XIII with the aid of plasma-based reference material SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2014-12-09 — — US disclosed
US-20120190052-A1 Method of determining factor XIII by means of NAD(P)H-analogues SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2012-07-26 — — US disclosed
US-20120190053-A1 Method of determining factor XIII with the aid of plasma-based reference material SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2012-07-26 — — US disclosed
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