SCHEMBL30919237

N=C(N)NCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	KISS1R	Q969F8	14/20	0.54

▸	SIRT5	Q9NXA8	1/20	0.53

▸	MC4R	P32245	2/20	0.52

▸	GHSR	Q92847	2/20	0.51

▸	ERAP2	Q6P179	1/20	0.51

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
SCHEMBL29462956	0.95	ERAP2 (0.53)	KISS1RSIRT5ERAP2
SCHEMBL29462962	0.95	ERAP2 (0.53)	KISS1RSIRT5ERAP2
SCHEMBL30903464	0.95	KISS1R (0.56)	KISS1R
SCHEMBL29636525	0.95	KISS1R (0.53)	KISS1RGHSR
SCHEMBL29637604	0.95	KISS1R (0.54)	KISS1R
SCHEMBL31406265	0.95	ERAP2 (0.54)	KISS1RSIRT5MC4RGHSRERAP2
SCHEMBL30919236	0.94	KISS1R (0.55)	KISS1RMC4RGHSR
SCHEMBL30919241	0.94	KISS1R (0.55)	KISS1RMC4RGHSR
SCHEMBL31206184	0.94	KISS1R (0.55)	KISS1RMC4RGHSR
SCHEMBL31249537	0.94	MC4R (0.55)	KISS1RMC4RGHSR

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-118085034-A	Broad-spectrum low-drug-resistance amphiphilic antibacterial peptide and application thereof	兰州大学	2024-05-28	—	—	CN	disclosed