SCHEMBL7417585

SCHEMBL7417585

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H]([C]=O)CS

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.45
▸ NPY1R P25929 6/20 0.45
▸ NPY2R P49146 4/20 0.45
▸ NPY5R Q15761 4/20 0.45
▸ KISS1R Q969F8 2/20 0.40
▸ ENPEP Q07075 7/20 0.40

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
SCHEMBL7415877 0.88 F2 (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL7461891 0.88 ENPEP (0.46) ENPEP
SCHEMBL29510886 0.87 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL7459011 0.85 BACE1 (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL7414407 0.83 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL31060878 0.82 ENPEP (0.47) KISS1RENPEP
SCHEMBL30512550 0.82 VIPR2 (0.48) NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL31169705 0.81 ENPEP (0.45) NPY4RNPY1RNPY2RNPY5RENPEP
SCHEMBL29599401 0.81 ENPEP (0.53) ENPEP
SCHEMBL30812335 0.81 NPY4R (0.50) NPY4RNPY1RNPY2RNPY5RKISS1R

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1990014362-A1 ATRIAL PEPTIDE DERIVATIVES ABBOTT LABORATORIES (US) 1990-11-29 — — WO disclosed
Send feedback