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Actinonin

Actinonin

SCHEMBL14490676

CCCCC[C@H](CC(=O)NO)C(=O)NC(C(=O)N1CCC[C@H]1CO)C(C)C

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BIRC2 Q13490 5/20 0.56
▸ MMP3 P08254 12/20 0.46
▸ MMP1 P03956 9/20 0.46
▸ MMP2 P08253 8/20 0.46
▸ MMP7 P09237 3/20 0.46
▸ MMP9 P14780 3/20 0.46
▸ MMP14 P50281 1/20 0.42
▸ PDF Q9HBH1 1/20 0.41

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
Actinonin SCHEMBL279450 1.00 BIRC2 (0.56) BIRC2MMP3MMP1MMP2MMP7
Actinonin SCHEMBL279122 1.00 BIRC2 (0.56) BIRC2MMP3MMP1MMP2MMP7
Actinonin SCHEMBL123273 1.00 BIRC2 (0.56) BIRC2MMP3MMP1MMP2MMP7
Actinonin SCHEMBL12601775 1.00 BIRC2 (0.56) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL6294118 0.97 BIRC2 (0.55) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL18328823 0.92 MMP3 (0.49) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL21387112 0.92 BIRC2 (0.47) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL14279424 0.90 BIRC2 (0.55) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL6294172 0.87 BIRC2 (0.58) BIRC2MMP3MMP1MMP2MMP7
SCHEMBL9495973 0.87 BIRC2 (0.44) BIRC2MMP3MMP1

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
EP-1792624-A1 Modified amino acids and compositions comprising them for delivering active agents Emisphere Technologies, Inc. (US) 2007-06-06 — — EP disclosed