SCHEMBL30136427

SCHEMBL30136427

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTH1R Q03431 10/20 0.55
▸ CRHR1 P34998 1/20 0.54
▸ CRHR2 Q13324 1/20 0.54
▸ CALCR P30988 4/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.49
▸ GRIN2D O15399 1/20 0.48
▸ GRIN3B O60391 1/20 0.48
▸ GRIN1 Q05586 1/20 0.48
▸ GRIN2A Q12879 1/20 0.48
▸ GRIN2B Q13224 1/20 0.48
▸ GRIN2C Q14957 1/20 0.48
▸ GRIN3A Q8TCU5 1/20 0.48
▸ F2 P00734 1/20 0.47
▸ GLP1R P43220 1/20 0.47

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
SCHEMBL30763286 0.94 PTH1R (0.52) PTH1RCRHR1CRHR2CALCRRXFP1
SCHEMBL29407403 0.94 PTH1R (0.59) PTH1RCRHR1CRHR2CALCRRXFP1
SCHEMBL31303964 0.94 PTH1R (0.59) PTH1RCRHR1CRHR2CALCRRXFP1
SCHEMBL30136490 0.94 PTH1R (0.59) PTH1RCRHR1CRHR2CALCRRXFP1
SCHEMBL30449532 0.90 PTH1R (0.65) PTH1RCALCRRXFP1GLP1R
SCHEMBL30512732 0.88 CRHR1 (0.50) PTH1RCRHR1CRHR2CALCRGRIN2D
SCHEMBL31307253 0.87 CRHR1 (0.49) PTH1RCRHR1CRHR2CALCRF2
SCHEMBL31182682 0.87 PTH1R (0.60) PTH1RCRHR1CRHR2CALCRRXFP1
SCHEMBL31656529 0.87 CALCR (0.62) CRHR1CRHR2CALCRGLP1R
SCHEMBL30262223 0.87 PTH1R (0.53) PTH1RRXFP1

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-110642936-B Method for preparing teriparatide 深圳翰宇药业股份有限公司 2023-01-17 — — CN disclosed
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