SCHEMBL30988909

SCHEMBL30988909

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

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.40
QRFPR Q96P65 3/20 0.39
NMT1 P30419 4/20 0.38
NMT2 O60551 3/20 0.38
MME P08473 4/20 0.37
OPRM1 P35372 3/20 0.36
OPRD1 P41143 3/20 0.36
SLC15A2 Q16348 1/20 0.36
OPRK1 P41145 1/20 0.35
PTGS1 P23219 1/20 0.35
GSTK1 Q9Y2Q3 1/20 0.35

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
SCHEMBL31424011 1.00 TGFBR1 (0.40) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL30956647 1.00 TGFBR1 (0.40) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL30956646 1.00 TGFBR1 (0.40) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL31423993 1.00 TGFBR1 (0.40) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL29828566 0.97 QRFPR (0.41) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL30851114 0.97 QRFPR (0.41) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL31383401 0.97 QRFPR (0.41) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL29475227 0.97 TGFBR1 (0.42) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL29530629 0.97 TGFBR1 (0.42) TGFBR1QRFPRNMT1NMT2MME
SCHEMBL29397392 0.97 TGFBR1 (0.42) TGFBR1QRFPRNMT1NMT2MME

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-118259000-A Brucella Omp16 antibody detection method based on luciferase subunit complementation and application thereof 西北农林科技大学 2024-06-28 CN disclosed