SCHEMBL29484171

SCHEMBL29484171

NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.41
▸ MMP2 P08253 1/20 0.40
▸ PSMB1 P20618 1/20 0.38
▸ PSMB8 P28062 1/20 0.38
▸ PSMB9 P28065 1/20 0.38
▸ PSMB5 P28074 1/20 0.38
▸ PSMB10 P40306 1/20 0.38
▸ PSMB2 P49721 1/20 0.38
▸ EGFR P00533 1/20 0.37
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36
▸ TUBB2A Q13885 1/20 0.36
▸ TUBB8 Q3ZCM7 1/20 0.36
▸ TUBA3E Q6PEY2 1/20 0.36
▸ TUBA1A Q71U36 1/20 0.36

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
SCHEMBL9616877 0.97 MMP2 (0.39) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL9200315 0.97 MMP2 (0.39) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL8427968 0.97 MMP2 (0.39) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL3357251 0.96 SLC15A2 (0.42) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL3357272 0.96 SLC15A2 (0.42) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL6116135 0.95 SLC15A2 (0.41) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL6116125 0.95 SLC15A2 (0.41) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL8431409 0.93 PSMB1 (0.39) SLC15A2MMP2PSMB1PSMB8PSMB9
SCHEMBL9180130 0.90 SLC15A2 (0.52) SLC15A2PSMB1PSMB8PSMB9PSMB5
SCHEMBL14332219 0.90 SLC15A2 (0.48) SLC15A2MMP2GHSR

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-112263712-B Peritoneal repair material with antibacterial property and preparation method thereof 中山大学附属第六医院 2022-04-29 — — CN disclosed
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