Sugi Predict

Sugi Predict / Compounds / SCHEMBL30437152

SCHEMBL30437152

SCHEMBL30437152

CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C)C(C)C

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 5/20 0.61
▸ TFPI P10646 1/20 0.53
▸ VIPR2 P41587 3/20 0.52
▸ GLP1R P43220 3/20 0.51
▸ PTH1R Q03431 1/20 0.51
▸ VIPR1 P32241 2/20 0.50
▸ ECE1 P42892 1/20 0.50
▸ MUS81 Q96NY9 1/20 0.50

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
SCHEMBL30436824 0.92 VIPR1 (0.56) RXFP1TFPIVIPR2PTH1RVIPR1
SCHEMBL30862319 0.91 RXFP1 (0.57) RXFP1TFPIGLP1RPTH1RVIPR1
SCHEMBL30607321 0.90 RXFP1 (0.60) RXFP1TFPIPTH1RVIPR1
SCHEMBL30712890 0.89 VIPR2 (0.58) RXFP1VIPR2PTH1RVIPR1
SCHEMBL29677393 0.89 RXFP1 (0.58) RXFP1TFPIVIPR2GLP1RPTH1R
SCHEMBL30536311 0.87 VIPR1 (0.55) RXFP1TFPIVIPR2GLP1RPTH1R
SCHEMBL29677265 0.87 VIPR2 (0.57) RXFP1TFPIVIPR2GLP1RPTH1R
SCHEMBL29677217 0.87 VIPR2 (0.57) RXFP1TFPIVIPR2GLP1RPTH1R
SCHEMBL29677337 0.86 RXFP1 (0.55) RXFP1TFPIVIPR2PTH1RVIPR1
SCHEMBL30437164 0.86 RXFP1 (0.49) RXFP1GLP1R

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-116103323-B Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof 安徽中医药大学 2024-10-22 — — CN disclosed
CN-116103323-A Polygonum multiflorum phenylalanine ammonia lyase gene FmPAL, and encoding product and application thereof 安徽中医药大学 2023-05-12 — — CN disclosed
Send feedback