SCHEMBL30148136

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	3/20	0.53

▸	OPRM1	P35372	2/20	0.53

▸	CCKAR	P32238	1/20	0.52

▸	CCKBR	P32239	1/20	0.52

▸	KISS1R	Q969F8	3/20	0.50

▸	IL23R	Q5VWK5	9/20	0.50

▸	C5AR1	P21730	1/20	0.50

▸	IL1RN	P18510	2/20	0.49

▸	ERAP2	Q6P179	2/20	0.49

▸	GRPR	P30550	2/20	0.48

▸	ERAP1	Q9NZ08	1/20	0.47

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
SCHEMBL30844082	0.92	OPRD1 (0.56)	OPRD1OPRM1CCKARCCKBRKISS1R
SCHEMBL31020750	0.89	OPRD1 (0.62)	OPRD1OPRM1CCKARCCKBRKISS1R
SCHEMBL29369087	0.87	IL23R (0.63)	IL23RC5AR1
SCHEMBL30512611	0.86	KISS1R (0.57)	OPRD1OPRM1CCKARCCKBRKISS1R
SCHEMBL30343162	0.85	OPRD1 (0.66)	OPRD1OPRM1CCKARCCKBRERAP2
SCHEMBL29568760	0.85	IL1RN (0.61)	OPRD1OPRM1CCKARCCKBRIL1RN
SCHEMBL30567414	0.83	ACE (0.55)	IL1RNERAP2ERAP1
SCHEMBL30084581	0.83	MAGI3 (0.51)	IL1RNERAP2ERAP1
SCHEMBL29550137	0.83	OPRD1 (0.48)	OPRD1OPRM1KISS1RIL23R
SCHEMBL30797170	0.82	OPRM1 (0.57)	OPRD1OPRM1IL1RNERAP2ERAP1

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
CN-112409450-B	Affinity agent of TIGIT-IgV and application thereof	郑州大学	2023-01-24	—	—	CN	disclosed