Valine

Valine

SCHEMBL8575925

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

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.65
SLC1A3 P43003 2/20 0.40
SLC1A2 P43004 2/20 0.40
SLC1A1 P43005 2/20 0.40
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32
GABRA2 P47869 2/20 0.32
GABRB2 P47870 2/20 0.32
GABRA4 P48169 2/20 0.32
GABRE P78334 2/20 0.32
GABRA6 Q16445 2/20 0.32
GABRG1 Q8N1C3 2/20 0.32
GABRG3 Q99928 2/20 0.32
GABRQ Q9UN88 2/20 0.32

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
Valine SCHEMBL9672476 0.84 SLC7A5 (0.75) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL9088823 0.84 SLC7A5 (0.75) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL547430 0.84 SLC7A5 (0.75) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL6360907 0.82 SLC7A5 (0.71) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL28052863 0.82 SLC7A5 (0.58) SLC7A5SLC1A3SLC1A2SLC1A1
Valine SCHEMBL3076649 0.81 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL3486854 0.81 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL229818 0.81 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL2017287 0.81 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1GABRP
Valine SCHEMBL20981544 0.81 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5808058-A Process for the preparation of 10-OXO-10, 11-dihydro-5H-dibenz (b,f) azepin-5-carboxamide TRIFARMA S.R.L. (IT) 1998-09-15 US disclosed
EP-0847390-A1 A PROCESS FOR THE PREPARATION OF 10-OXO-10,11-DIHYDRO-5H-DIBENZ(b,f)AZEPIN-5-CARBOXAMIDE TRIFARMA, S.R.L. (IT) 1998-06-17 EP disclosed
WO-1996021649-A1 A PROCESS FOR THE PREPARATION OF 10-OXO-10,11-DIHYDRO-5H-DIBENZ(b,f)AZEPIN-5-CARBOXAMIDE TRIFARMA, S.R.L. (IT) 1996-07-18 WO disclosed
US-5247071-A Coupling diazonium salt with hydroxyalkylaniline derivative; etherification with a vinyl ether BASF AKTIENGESELLSCHAFT (DE) 1993-09-21 US disclosed