SCHEMBL29539031

SCHEMBL29539031

NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
QRFPR Q96P65 7/20 0.43
TGFBR1 P36897 1/20 0.40
BMP1 P13497 1/20 0.38
NMT2 O60551 2/20 0.38
NMT1 P30419 2/20 0.38
CA2 P00918 3/20 0.36
CA1 P00915 2/20 0.36
TASP1 Q9H6P5 1/20 0.36
KMT2A Q03164 1/20 0.35
NOD1 Q9Y239 1/20 0.35
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34

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
SCHEMBL29630461 0.91 FOLH1 (0.41) QRFPRTGFBR1BMP1NMT2NMT1
SCHEMBL30903444 0.90 TGFBR1 (0.45) TGFBR1BMP1NMT2NMT1CA2
SCHEMBL30933103 0.90 TGFBR1 (0.45) TGFBR1BMP1NMT2NMT1CA2
SCHEMBL4170252 0.87 KMT2A (0.43) CA2CA1KMT2ANOD1MMP2
SCHEMBL29410190 0.87 TGFBR1 (0.43) QRFPRTGFBR1NMT2NMT1
SCHEMBL9015874 0.87 KMT2A (0.43) CA2CA1KMT2ANOD1MMP2
SCHEMBL31465332 0.86 KMT2A (0.43) CA2CA1KMT2ANOD1MMP2
SCHEMBL16418501 0.86 KMT2A (0.43) CA2CA1KMT2ANOD1MMP2
SCHEMBL30754137 0.86 QRFPR (0.42) QRFPRTGFBR1NMT2NMT1
SCHEMBL29613144 0.86 KMT2A (0.43) CA2CA1KMT2ANOD1MMP2

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-114395025-B Paraffin anti-freeze protein gene ep-afp and application thereof 昆明学院 2023-08-08 CN disclosed
CN-114395025-A Paralichthys atranus antifreeze protein gene ep-afp and application thereof 昆明学院 2022-04-26 CN disclosed