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Sugi Predict / Compounds / SCHEMBL29479812

SCHEMBL29479812

SCHEMBL29479812

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 5/20 0.60
▸ EP300 Q09472 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ MAPK8 P45983 1/20 0.57
▸ MAPK9 P45984 1/20 0.57
▸ MAPK10 P53779 1/20 0.57
▸ NPY2R P49146 7/20 0.54
▸ NPY4R P50391 7/20 0.54
▸ NPY5R Q15761 7/20 0.54
▸ NPY1R P25929 5/20 0.54
▸ NMUR2 Q9GZQ4 2/20 0.53
▸ NMUR1 Q9HB89 2/20 0.53
▸ TFPI P10646 1/20 0.53

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
SCHEMBL30277959 0.98 KEAP1 (0.60) KEAP1EP300HIF1AMAPK8MAPK9
SCHEMBL30277956 0.96 EP300 (0.63) KEAP1EP300HIF1ANPY2RNPY4R
SCHEMBL30648455 0.94 EP300 (0.64) KEAP1EP300HIF1ANPY2RNPY4R
SCHEMBL31182641 0.89 MAPK8 (0.63) KEAP1EP300HIF1AMAPK8MAPK9
SCHEMBL31000870 0.88 MAPK8 (0.67) EP300HIF1AMAPK8MAPK9MAPK10
SCHEMBL30432021 0.87 NPY2R (0.68) KEAP1EP300HIF1ANPY2RNPY4R
SCHEMBL30887974 0.87 KEAP1 (0.64) KEAP1EP300HIF1AMAPK8MAPK9
SCHEMBL30495583 0.87 NPY2R (0.65) EP300HIF1AMAPK8MAPK9MAPK10
SCHEMBL31711737 0.87 MAPK8 (0.57) KEAP1MAPK8MAPK9MAPK10NPY2R
SCHEMBL31005076 0.87 MAPK8 (0.61) KEAP1EP300HIF1AMAPK8MAPK9

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-114213534-B Anti-human PlGF (platelet-derived growth factor) murine monoclonal antibody and application thereof 南京佰抗生物科技有限公司 2022-06-03 — — CN disclosed
CN-114213534-A Anti-human PlGF (platelet-derived growth factor) mouse-derived monoclonal antibody and application thereof 南京佰抗生物科技有限公司 2022-03-22 — — CN disclosed
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