SCHEMBL28175424

SCHEMBL28175424

Nc1nc(=O)c2nccnc2n1CBr

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 2/20 0.35
▸ ADORA3 P0DMS8 1/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ ADORA1 P30542 1/20 0.31

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
SCHEMBL29249153 0.75 — —
SCHEMBL29005408 0.74 DAO (0.32) —
SCHEMBL452643 0.74 — —
SCHEMBL29184288 0.72 — —
SCHEMBL29249152 0.69 — —
SCHEMBL28099144 0.64 — —
SCHEMBL28715735 0.64 — —
SCHEMBL5667528 0.56 ADORA2B (0.47) PNPADORA3ADORA2AADORA2BADORA1
SCHEMBL19153111 0.56 ADORA1 (0.41) ADORA3ADORA2AADORA2BADORA1
Pterine SCHEMBL906055 0.54 ALDH1A1 (0.40) PNPADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107245082-B Synthesis method of 6-pterin folic acid 天津阿尔塔科技有限公司 2020-04-17 — — CN claimed
CN-107245082-A A kind of synthetic method of 6 pterin base folic acid 天津阿尔塔科技有限公司 2017-10-13 — — CN claimed
CN-107245082-B Synthesis method of 6-pterin folic acid 天津阿尔塔科技有限公司 2020-04-17 — — CN disclosed
CN-107245082-B Synthesis method of 6-pterin folic acid 天津阿尔塔科技有限公司 2020-04-17 — — CN disclosed
CN-107245082-A A kind of synthetic method of 6 pterin base folic acid 天津阿尔塔科技有限公司 2017-10-13 — — CN disclosed
CN-107245082-A A kind of synthetic method of 6 pterin base folic acid 天津阿尔塔科技有限公司 2017-10-13 — — CN disclosed
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