Pala

Pala

SCHEMBL3514468

N[C@@H](CCC(=O)O)C(=O)O.O=C(O)C[C@H](NC(=O)CP(=O)(O)O)C(=O)O

nearest known ligand 0.72

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.72
CA4 P22748 1/20 0.72
FOLH1 Q04609 4/20 0.54
GRM8 O00222 2/20 0.50
GRM6 O15303 2/20 0.50
GRM7 Q14831 2/20 0.50
GRM4 Q14833 2/20 0.50
OTC P00480 1/20 0.50
GRIN2D O15399 1/20 0.50
GRIN3B O60391 1/20 0.50
GSR P00390 1/20 0.50
CYP1A2 P05177 1/20 0.50
GRIK1 P39086 1/20 0.50
GRM5 P41594 1/20 0.50
GRIA1 P42261 1/20 0.50
GRIA2 P42262 1/20 0.50
GRIA3 P42263 1/20 0.50
SLC1A3 P43003 1/20 0.50
SLC1A2 P43004 1/20 0.50
SLC1A1 P43005 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
Pala SCHEMBL59449 0.85 CA2 (1.00) CA2CA4FOLH1OTC
Sparfosic Acid SCHEMBL3514530 0.85 CA2 (1.00) CA2CA4FOLH1OTC
Sparfosic Acid SCHEMBL31237824 0.83 CA2 (0.96) CA2CA4FOLH1OTC
Pala SCHEMBL859680 0.83 CA2 (0.96) CA2CA4FOLH1OTC
Pala SCHEMBL11121904 0.83 CA2 (0.96) CA2CA4FOLH1OTC
Pala SCHEMBL31389020 0.83 CA2 (0.96) CA2CA4FOLH1OTC
SCHEMBL12990268 0.83 CA2 (0.71) CA2CA4FOLH1
SCHEMBL3513056 0.83 CA2 (0.71) CA2CA4FOLH1
SCHEMBL10423054 0.82 NOD1 (0.57) CA2CA4FOLH1GRM8GRM6
SCHEMBL9225913 0.82 NOD1 (0.57) CA2CA4FOLH1GRM8GRM6

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100303715-A1 Prostate-specific membrane antigen and uses thereof ISRAELI RON S 2010-12-02 US disclosed
US-7399461-B2 Prostate-specific membrane antigen and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2008-07-15 US disclosed
EP-1754788-A2 Prostate-specific membrane antigen and uses thereof Sloan-Kettering Institute For Cancer Research (US) 2007-02-21 EP disclosed
US-7037647-B1 Prostate-specific membrane antigen and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-05-02 US disclosed
US-20040253246-A1 Prostate-specific membrane antigen and uses thereof ISRAELI RON S (US) 2004-12-16 US disclosed
EP-0812356-A4 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF SLOAN KETTERING INST CANCER (US) 2002-04-03 EP disclosed
EP-0812356-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF Sloan-Kettering Institute For Cancer Research (US) 1997-12-17 EP disclosed
WO-1996026272-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1996-08-29 WO disclosed