Sugi Predict

Sugi Predict / Compounds / SCHEMBL29833226

SCHEMBL29833226

SCHEMBL29833226

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)CC

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.62
▸ APLNR P35414 2/20 0.58
▸ NPY2R P49146 7/20 0.57
▸ NPY4R P50391 7/20 0.57
▸ NPY5R Q15761 7/20 0.57
▸ NPY1R P25929 5/20 0.57
▸ CALCR P30988 3/20 0.55
▸ TFPI P10646 1/20 0.55

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
SCHEMBL30432035 0.90 NPY2R (0.59) F2APLNRNPY2RNPY4RNPY5R
SCHEMBL30437136 0.88 NPY2R (0.61) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30432875 0.88 CALCR (0.65) F2APLNRNPY2RNPY4RNPY5R
SCHEMBL29797992 0.88 C5AR1 (0.58) APLNRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30495635 0.87 NPY2R (0.66) F2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30537477 0.87 NPY2R (0.65) F2NPY2RNPY4RNPY5RNPY1R
SCHEMBL29678024 0.86 OPRM1 (0.58) APLNRCALCR
SCHEMBL30262233 0.86 CALCR (0.64) F2NPY2RNPY4RNPY5RNPY1R
SCHEMBL30974242 0.86 CALCR (0.62) F2NPY2RNPY4RNPY5RNPY1R
SCHEMBL29798261 0.86 C5AR1 (0.60) APLNRCALCRTFPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111285922-B Drosophila polypeptide for promoting tissue repair and preparation method and application thereof 南京中医药大学 2022-06-10 — — CN claimed
CN-111285922-B Drosophila polypeptide for promoting tissue repair and preparation method and application thereof 南京中医药大学 2022-06-10 — — CN disclosed
CN-111285922-B Drosophila polypeptide for promoting tissue repair and preparation method and application thereof 南京中医药大学 2022-06-10 — — CN disclosed
Send feedback