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Arginine

Arginine

SCHEMBL181305

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.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](CO)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]1CCCN1.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 SCHEMBL181614 0.96 APLNR (0.31) APLNR
Histidine SCHEMBL7765125 0.82 — —
Arginine SCHEMBL16265969 0.79 APLNR (0.34) APLNR
Arginine SCHEMBL6868910 0.79 APLNR (0.33) APLNR
Arginine SCHEMBL27090217 0.78 TUBB4A (0.36) APLNR
Histidine SCHEMBL2513267 0.78 — —
Arginine SCHEMBL23456962 0.78 GLP1R (0.34) APLNR
Histidine SCHEMBL5578065 0.78 — —
Arginine SCHEMBL18042250 0.78 TUBB4A (0.32) APLNR
Leucine SCHEMBL10439243 0.77 APLNR (0.32) APLNR

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 2 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-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