Cephapirin

Cephapirin

SCHEMBL23630215

CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CSc3ccncc3)[C@H]2SC1.[Na+].[NaH]

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Cephapirin. 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
TDP1 Q9NUW8 11/20 0.98
MAPT P10636 8/20 0.98
HSD17B10 Q99714 5/20 0.98
CYP3A4 P08684 4/20 0.98
KDM4E B2RXH2 4/20 0.98
LMNA P02545 4/20 0.98
APEX1 P27695 4/20 0.98
L3MBTL1 Q9Y468 4/20 0.98
POLB P06746 3/20 0.98
RECQL P46063 2/20 0.98
CYP2D6 P10635 1/20 0.98
NR1I2 O75469 3/20 0.83
BLM P54132 3/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
HPGD P15428 2/20 0.66
PKM P14618 2/20 0.66
NPSR1 Q6W5P4 2/20 0.66
GLA P06280 1/20 0.66
PTPN7 P35236 1/20 0.66

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
Cephapirin SCHEMBL9437558 0.99 TDP1 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL64430 0.99 TDP1 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL28121684 0.92 TDP1 (0.86) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL9437555 0.92 NR1I2 (0.98) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL151779 0.92 NR1I2 (0.98) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL8194062 0.91 NR1I2 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL11844793 0.91 NR1I2 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL16072823 0.91 NR1I2 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL3205 0.91 NR1I2 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E
Cephapirin SCHEMBL11844804 0.91 NR1I2 (1.00) TDP1MAPTHSD17B10CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3846778-A1 ORAL FILM COMPOSITIONS AND DOSAGE FORMS HAVING PRECISE ACTIVE DISSOLUTION PROFILES Aquestive Therapeutics, Inc. (US) 2021-07-14 EP disclosed