SCHEMBL29593091

SCHEMBL29593091

CSCC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.58
▸ CALCR P30988 4/20 0.57
▸ NTSR1 P30989 1/20 0.55
▸ CRHR1 P34998 1/20 0.54
▸ CRHR2 Q13324 1/20 0.54
▸ APLNR P35414 1/20 0.53
▸ SLC6A2 P23975 1/20 0.53
▸ NMBR P28336 1/20 0.51
▸ GRPR P30550 1/20 0.51
▸ NMUR2 Q9GZQ4 1/20 0.51
▸ MC4R P32245 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL30209621 0.96 F2 (0.60) F2CALCRNTSR1SLC6A2NMUR2
SCHEMBL30997464 0.88 F2 (0.60) F2CALCRNTSR1CRHR1CRHR2
SCHEMBL30712932 0.86 F2 (0.65) F2CALCRCRHR1CRHR2MC4R
SCHEMBL30504289 0.86 CALCR (0.61) F2CALCRNTSR1CRHR1CRHR2
SCHEMBL31174210 0.86 MC4R (0.60) F2CALCRAPLNRNMUR2MC4R
SCHEMBL29699958 0.86 SLC6A2 (0.59) NTSR1SLC6A2
SCHEMBL10432709 0.85 NTSR1 (0.58) NTSR1SLC6A2NMUR2
SCHEMBL10432711 0.85 NTSR1 (0.58) NTSR1SLC6A2NMUR2
SCHEMBL31020744 0.85 SLC6A2 (0.63) NTSR1SLC6A2NMUR2
SCHEMBL31130616 0.84 MC4R (0.57) F2CALCRNTSR1CRHR1CRHR2

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
CN-114426581-A Enolase monoclonal antibody and preparation method and application thereof 陕西脉元生物科技有限公司 2022-05-03 — — CN disclosed
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