Erlotinib

Erlotinib

SCHEMBL28471753

C#Cc1cccc(Nc2ncnc3cc(OCCOC)c(OCCOC)cc23)c1.OCl

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

EGFR

The experimentally established mechanism targets of Erlotinib. 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
EGFR known ✓ P00533 15/20 0.94
ERBB2 P04626 7/20 0.94
GAK O14976 4/20 0.94
KDR P35968 3/20 0.94
ILK Q13418 2/20 0.94
FLT1 P17948 2/20 0.94
RIPK2 O43353 2/20 0.94
BUB1 O43683 2/20 0.94
STK10 O94804 2/20 0.94
ABL1 P00519 2/20 0.94
LCK P06239 2/20 0.94
LYN P07948 2/20 0.94
RET P07949 2/20 0.94
SRC P12931 2/20 0.94
FGFR2 P21802 2/20 0.94
FECH P22830 2/20 0.94
FLT3 P36888 2/20 0.94
MAP3K1 Q13233 2/20 0.94
PLK4 O00444 1/20 0.94
CIT O14578 1/20 0.94

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
Erlotinib SCHEMBL29120903 0.97 EGFR (0.96) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL30362833 0.97 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL29351329 0.97 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL3667407 0.97 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL8413 0.97 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL1959332 0.96 EGFR (0.98) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL18563 0.96 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL21176918 0.96 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL16767632 0.96 EGFR (1.00) EGFRERBB2GAKKDRILK
Erlotinib SCHEMBL417841 0.96 EGFR (0.98) EGFRERBB2GAKKDRILK

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-111904508-A Surgical suturing device 柯惠LP公司 2020-11-10 CN claimed
CN-111904509-A Surgical suturing device 柯惠LP公司 2020-11-10 CN claimed
CN-111904507-A Surgical suturing device 柯惠LP公司 2020-11-10 CN claimed
CN-115803092-A SIRP alpha deficient macrophages for the treatment of cancer 乔治亚州立大学研究基金公司 2023-03-14 CN disclosed
CN-112770779-B Cellulose composition, tablet and orally disintegrating tablet 旭化成株式会社 2022-07-22 CN disclosed
CN-114514035-A Compositions and methods for delivering therapeutic biologies for treatment of diseases 伊勒卓菲公司 2022-05-17 CN disclosed
CN-114466658-A Orally delivered therapeutic compositions and uses thereof 沈海发 2022-05-10 CN disclosed
CN-114340636-A Method of treatment 细胞内治疗公司 2022-04-12 CN disclosed
CN-113366023-A Compositions and methods for stimulating natural killer cells 弗罗里达中央大学研究基金会 2021-09-07 CN disclosed