Proline

Proline

SCHEMBL140698

N[C@@H](COC(=O)[C@@H]1CCCN1)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

The experimentally established mechanism targets of Proline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.34
NOS2 P35228 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
DPP4 P27487 2/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
BLM P54132 1/20 0.33
ELANE P08246 1/20 0.32
SLC1A5 Q15758 1/20 0.32
FAP Q12884 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
PRCP P42785 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL2043828 0.96 NOS2 (0.37) TLR2NOS2NOS3NOS1DPP4
Proline SCHEMBL3519298 0.95 TLR2 (0.32) TLR2NOS2NOS3NOS1DPP4
Alanine SCHEMBL5970554 0.90 TLR2 (0.36) TLR2NOS2NOS3NOS1DPP4
Proline SCHEMBL4604674 0.87 TLR2 (0.34) TLR2NOS2NOS3NOS1DPP4
Proline SCHEMBL3105891 0.87 KMT2A (0.38) MEN1KMT2ABLM
SCHEMBL3100834 0.85 TLR2 (0.30) TLR2
Proline SCHEMBL2588288 0.85 TLR2 (0.30) TLR2
Lysine SCHEMBL6151465 0.84 GSR (0.49) TLR2DPP4DPP8DPP9FAP
Proline SCHEMBL8582773 0.83 TLR2 (0.34) TLR2NOS2NOS3NOS1DPP7
Phenylalanine SCHEMBL5672080 0.82 SLC7A5 (0.51) DPP4DPP8DPP9ELANESLC1A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673854-B2 Prophylactic agent for heart failure CALPIS CO., LTD. (JP) 2014-03-18 US disclosed
EP-2138184-B1 TRIPEPTIDES FOR USE IN PREVENTING KIDNEY GLOMERULAR DISEASE CALPIS CO LTD (JP) 2013-09-18 EP disclosed
EP-2130546-B1 TRIPEPTIDES FOR USE IN TREATING HEART WALL THICKENING CALPIS CO LTD (JP) 2013-02-27 EP disclosed
US-20120077735-A1 PROPHYLACTIC AGENT FOR RENAL FAILURE HIROTA TATSUHIKO (JP) 2012-03-29 US disclosed
US-20120058947-A1 PROPHYLACTIC AGENT FOR HEART FAILURE ASAHI GROUP FOODS, LTD. (JP) 2012-03-08 US disclosed
US-20100022748-A1 PROPHYLACTIC AGENT FOR RENAL FAILURE CALPIS CO., LTD. (JP) 2010-01-28 US disclosed
US-20100022747-A1 PROPHYLACTIC AGENT FOR HEART FAILURE CALPIS CO., LTD. (JP) 2010-01-28 US disclosed
EP-2138184-A1 PROPHYLACTIC AGENT FOR RENAL FAILURE Calpis Co., Ltd. (JP) 2009-12-30 EP disclosed
EP-2130546-A1 PROPHYLACTIC AGENT FOR HEART FAILURE Calpis Co., Ltd. (JP) 2009-12-09 EP disclosed