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Sugi Predict / Compounds / SCHEMBL29633548

SCHEMBL29633548

SCHEMBL29633548

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ UTS2R Q9UKP6 1/20 0.56
▸ GHSR Q92847 2/20 0.53
▸ IL23R Q5VWK5 4/20 0.51
▸ PRKACB P22694 1/20 0.51
▸ ACE P12821 1/20 0.50
▸ NPY1R P25929 1/20 0.49
▸ NPY2R P49146 1/20 0.49
▸ NPY4R P50391 1/20 0.49

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
SCHEMBL30537080 0.98 UTS2R (0.56) UTS2RGHSRIL23RPRKACBACE
SCHEMBL29699792 0.95 GHSR (0.56) UTS2RGHSRPRKACBACENPY1R
SCHEMBL29609768 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL29790169 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL29790108 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL29484173 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL29702283 0.95 GHSR (0.56) UTS2RGHSRPRKACBACENPY1R
SCHEMBL31593359 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL29609515 0.95 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R
SCHEMBL30990571 0.94 GHSR (0.56) UTS2RGHSRPRKACBNPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114569488-A Antibacterial peptide modified nanocellulose hydrogel, preparation method and application thereof 宁波糖聚新材料有限责任公司 2022-06-03 — — CN claimed
CN-114569488-A Antibacterial peptide modified nanocellulose hydrogel, preparation method and application thereof 宁波糖聚新材料有限责任公司 2022-06-03 — — CN disclosed
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