SCHEMBL9819593

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	15/20	0.71

▸	OPRM1	P35372	9/20	0.71

▸	OPRK1	P41145	2/20	0.71

▸	CCKAR	P32238	2/20	0.59

▸	CCKBR	P32239	2/20	0.59

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
SCHEMBL30898605	0.93	OPRD1 (0.62)	OPRD1OPRM1OPRK1
Dadle SCHEMBL28363457	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
Dadle SCHEMBL11396067	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
Dadle SCHEMBL11396064	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
Dadle SCHEMBL16620196	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
Dadle SCHEMBL11124725	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
Dadle SCHEMBL11683986	0.92	OPRD1 (0.80)	OPRD1OPRM1OPRK1
SCHEMBL29925300	0.90	OPRD1 (0.74)	OPRD1OPRM1OPRK1
SCHEMBL11491134	0.89	OPRD1 (0.78)	OPRD1OPRM1OPRK1
SCHEMBL9819596	0.89	OPRD1 (0.67)	OPRD1OPRM1OPRK1CCKARCCKBR

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-5002933-A	Antiulcer agents from tyrosine, alanine, glycine, phenylalanine, leucine and glutamic acid	VINOGRADOV VALENTIN A (SU)	1991-03-26	—	—	US	disclosed