SCHEMBL5494124

SCHEMBL5494124

NC(=O)N[C@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 3/20 0.61
▸ ICAM1 P05362 3/20 0.61
▸ ITGAL P20701 3/20 0.61
▸ CYP3A4 P08684 3/20 0.60
▸ SLC7A5 Q01650 1/20 0.60
▸ CA1 P00915 3/20 0.60
▸ CA2 P00918 3/20 0.60
▸ SLC15A2 Q16348 1/20 0.55
▸ SLC6A5 Q9Y345 1/20 0.54
▸ CPB2 Q96IY4 1/20 0.52
▸ EPHX2 P34913 1/20 0.49
▸ AGTR2 P50052 1/20 0.49
▸ GGT1 P19440 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ GABRA1 P14867 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ GABRR1 P24046 1/20 0.47
▸ GABRR2 P28476 1/20 0.47
▸ GABRA5 P31644 1/20 0.47

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
SCHEMBL14952736 1.00 ITGB2 (0.61) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL27413426 0.88 ITGB2 (0.67) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL30081493 0.85 SLC15A2 (0.72) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL2197786 0.85 SLC15A2 (0.72) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL468830 0.85 ITGB2 (0.64) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL6026427 0.85 ITGB2 (0.64) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL15683044 0.85 ITGB2 (0.64) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL17846596 0.84 CYP3A4 (0.64) ITGB2ICAM1ITGALCYP3A4SLC7A5
SCHEMBL21828671 0.84 CYP3A4 (0.68) ITGB2ICAM1ITGALCYP3A4SLC7A5
Water SCHEMBL8680774 0.84 ITGB2 (0.63) ITGB2ICAM1ITGALCYP3A4SLC7A5

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
CN-1376202-A Stereostructure of decarbamylase and use thereof KANEGAFUCHI CHEMICAL IND (JP) 2002-10-23 — — CN claimed
EP-1209234-A1 STEREOSTRUCTURE OF DECARBAMYLASE AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2002-05-29 — — EP claimed
EP-1616945-B1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI CHEMICAL IND (JP) 2007-11-21 — — EP disclosed
EP-0801131-B1 PROCESS FOR PRODUCING D-N-CARBAMOYL-ALPHA-AMINO ACID KANEGAFUCHI CHEMICAL IND (JP) 2007-02-21 — — EP disclosed
EP-1616945-A1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2006-01-18 — — EP disclosed
EP-1616946-A1 Process for producing D-N-carbamoyl-alpha-amino acids KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2006-01-18 — — EP disclosed
CN-1376202-A Stereostructure of decarbamylase and use thereof KANEGAFUCHI CHEMICAL IND (JP) 2002-10-23 — — CN disclosed
EP-1209234-A1 STEREOSTRUCTURE OF DECARBAMYLASE AND METHOD OF USING THE SAME Kaneka Corporation (JP) 2002-05-29 — — EP disclosed
EP-0801131-A1 PROCESS FOR PRODUCING D-N-CARBAMOYL-$g(a)-AMINO ACID Kanegafuchi Chemical Industry Co., Ltd. (JP) 1997-10-15 — — EP disclosed
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