Creatine

Creatine

SCHEMBL7858043

CN(CC(=O)[O-])C(=N)N.CN(CC(=O)[O-])C(=N)N.[Zn+2]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 18/20 0.41
▸ CA2 P00918 18/20 0.41
▸ NOS3 P29474 1/20 0.39
▸ NOS1 P29475 1/20 0.39
▸ NOS2 P35228 1/20 0.39

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
Creatine SCHEMBL5569335 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL3807770 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL3816605 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL6673726 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL4885845 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL4269044 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL675800 0.95 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL9391271 0.93 CA1 (0.41) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL1065566 0.88 NOS3 (0.39) CA1CA2NOS3NOS1NOS2
Creatine SCHEMBL9568829 0.88 NOS3 (0.39) CA1CA2NOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180280430-A1 COMPOSITION FOR IMPROVED PERFORMANCE BALCHEM CORPORATION 2018-10-04 — — US disclosed
EP-3355989-A1 COMPOSITION FOR IMPROVED PERFORMANCE Balchem Corporation (US) 2018-08-08 — — EP disclosed
WO-2001004128-A1 BIOAVAILABLE CHELATES OF CREATINE AND ESSENTIAL METALS ALBION INTERNATIONAL, INC. (US) 2001-01-18 — — WO disclosed
US-6114379-A Bioavailable chelates of creatine and essential metals ALBION LABORATORIES, INC. (US) 2000-09-05 — — US disclosed
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