Proline

Proline

SCHEMBL5503058

NC(=O)CC[C@H](N)C(=O)Oc1ccc(C[C@@H](N)C(=O)O)cc1.NC(=O)C[C@H](N)C(=O)OC(=O)[C@@H](N)CC(N)=O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.34

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 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.34
PTPN1 P18031 1/20 0.34
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 1/20 0.33
DPP4 P27487 2/20 0.32
CTSC P53634 3/20 0.32
TPH1 P17752 1/20 0.31
PTGS1 P23219 2/20 0.31
ALPI P09923 1/20 0.31
PKM P14618 1/20 0.31
XIAP P98170 1/20 0.31
KDM4E B2RXH2 2/20 0.31
FAP Q12884 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
ALOX15 P16050 3/20 0.30
PMP22 Q01453 2/20 0.30

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
Asparagine SCHEMBL4188697 0.90 ITGB3 (0.30) ITGB3ITGA2B
Proline SCHEMBL28237451 0.87 PTPN1 (0.38) SLC7A5PTPN1ITGB3ITGA2BHTR2C
Leucine SCHEMBL17065117 0.83 REN (0.33)
Tyrosine SCHEMBL28644593 0.83 SLC7A5 (0.35) SLC7A5HTR2CHTR2BDPP4KDM4E
Leucine SCHEMBL5151721 0.83 REN (0.34)
Glutamine SCHEMBL8134265 0.81 ALOX15 (0.47) SLC7A5PTPN1ITGB3ITGA2BTPH1
Tyrosine SCHEMBL28179550 0.80 SLC7A5 (0.51) SLC7A5DPP4CTSCTPH1PTGS1
Phenylalanine SCHEMBL15901818 0.80 SLC7A5 (0.49) SLC7A5HTR2CHTR2BDPP4CTSC
Histidine SCHEMBL8084688 0.80
Proline SCHEMBL17728310 0.79 PTPN1 (0.43) SLC7A5PTPN1ITGB3ITGA2BHTR2C

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
EP-1779393-A1 ANTISTATIC AGENT, ANTISTATIC FILM AND PRODUCT COATED WITH ANTISTATIC FILM SHOWA DENKO KABUSHIKI KAISHA (JP) 2007-05-02 EP disclosed
WO-2006016670-A1 ANTISTATIC AGENT, ANTISTATIC FILM AND PRODUCT COATED WITH ANTISTATIC FILM SHOWA DENKO K.K. (JP) 2006-02-16 WO disclosed