SCHEMBL18854267

SCHEMBL18854267

CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](C)C(C)=O

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 5/20 0.55
▸ REN P00797 3/20 0.54
▸ NMBR P28336 3/20 0.53
▸ EDNRA P25101 1/20 0.49
▸ IL1RN P18510 1/20 0.49
▸ ERAP2 Q6P179 1/20 0.49

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
SCHEMBL18862442 0.94 GHSR (0.56) GHSRRENNMBREDNRAERAP2
SCHEMBL18854334 0.88 GHSR (0.56) GHSRRENNMBRIL1RNERAP2
SCHEMBL18854271 0.88 GHSR (0.56) GHSRRENNMBRIL1RNERAP2
SCHEMBL18854326 0.88 GHSR (0.56) GHSRRENNMBRIL1RNERAP2
SCHEMBL18854269 0.85 GHSR (0.60) GHSRREN
SCHEMBL18862334 0.84 GHSR (0.57) GHSRRENNMBRERAP2
SCHEMBL18862366 0.83 GHSR (0.60) GHSRRENNMBR
SCHEMBL18854322 0.83 IL23R (0.60) GHSRREN
SCHEMBL22722178 0.83 GHSR (0.65) GHSRRENNMBR
SCHEMBL18854323 0.83 GHSR (0.59) GHSRREN

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
US-20170137801-A1 TISSUE-SPECIFIC GENOME ENGINEERING USING CRISPR-CAS9 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-05-18 — — US disclosed
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