SCHEMBL18854276

CC(C)C[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(=O)N[C@@H](CSSc1ncccc1[N+](=O)[O-])C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	GHSR	Q92847	3/20	0.47

▸	GRPR	P30550	10/20	0.47

▸	SLC2A1	P11166	2/20	0.45

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.

Compound	similarity	top predicted	shared targets
SCHEMBL18854272	0.90	GRPR (0.49)	GRPR
SCHEMBL18854328	0.85	GHSR (0.49)	GHSRGRPRSLC2A1
SCHEMBL18854323	0.85	GHSR (0.59)	GHSR
SCHEMBL18854274	0.85	GRPR (0.53)	GRPR
SCHEMBL18854331	0.84	GHSR (0.56)	GHSRGRPR
SCHEMBL18854269	0.83	GHSR (0.60)	GHSRGRPR
SCHEMBL18857391	0.81	GHSR (0.45)	GHSRGRPRSLC2A1
SCHEMBL18857765	0.80	GHSR (0.51)	GHSRGRPR
SCHEMBL18854321	0.80	GRPR (0.50)	GRPR
SCHEMBL30824287	0.74	GHSR (0.63)	GHSR

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20170137801-A1	TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9	THE REGENTS OF THE UNIVERSITY OF CALIFORNIA	2017-05-18	—	—	US	disclosed