Sugi Predict

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Arginine

Arginine

SCHEMBL181614

CC(C)C[C@H](N)C(=O)OC[C@H](N)C(=O)OC(=O)CN.CC(C)[C@H](N)C(=O)O.CSCC[C@H](N)C(=O)OC(=O)[C@@H](N)COC(=O)[C@@H](N)Cc1c[nH]cn1.CSCC[C@H](N)C(=O)OC[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.NCC(=O)O.NCC(=O)OC[C@H](N)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)OC[C@H](N)C(=O)OC(=O)[C@@H](N)Cc1c[nH]cn1.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACE

The experimentally established mechanism targets of Arginine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 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
Arginine SCHEMBL181305 0.96 APLNR (0.31) APLNR
Arginine SCHEMBL27090217 0.81 TUBB4A (0.36) APLNR
Histidine SCHEMBL5578065 0.81 — —
Arginine SCHEMBL27507048 0.80 APLNR (0.38) APLNR
Arginine SCHEMBL22042775 0.79 TUBB4A (0.33) —
Arginine SCHEMBL18042250 0.79 TUBB4A (0.32) APLNR
Histidine SCHEMBL7765125 0.78 — —
Arginine SCHEMBL6868910 0.78 APLNR (0.33) APLNR
Arginine SCHEMBL16265969 0.78 APLNR (0.34) APLNR
Arginine SCHEMBL18042246 0.78 TUBB4A (0.33) —

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
EP-2402444-A1 Modulators of body weight, corresponding nucleic acids and proteins, and diagnostic and therapeutic uses thereof THE ROCKEFELLER UNIVERSITY (US) 2012-01-04 — — EP claimed
EP-0777732-A1 MODULATORS OF BODY WEIGHT, CORRESPONDING NUCLEIC ACIDS AND PROTEINS, AND DIAGNOSTIC AND THERAPEUTIC USES THEREOF THE ROCKEFELLER UNIVERSITY (US) 1997-06-11 — — EP claimed
WO-1996005309-A2 MODULATORS OF BODY WEIGHT, CORRESPONDING NUCLEIC ACIDS AND PROTEINS, AND DIAGNOSTIC AND THERAPEUTIC USES THEREOF THE ROCKEFELLER UNIVERSITY (US) 1996-02-22 — — WO claimed
EP-2402444-A1 Modulators of body weight, corresponding nucleic acids and proteins, and diagnostic and therapeutic uses thereof THE ROCKEFELLER UNIVERSITY (US) 2012-01-04 — — EP disclosed