Isobutane

Isobutane

SCHEMBL28089335

CC(C)C.NC(=O)NC(N)=O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.56
LMNA P02545 4/20 0.41
TSHR P16473 3/20 0.41
NFKB1 P19838 2/20 0.41
BLM P54132 2/20 0.41
PMP22 Q01453 2/20 0.41
CYP1A2 P05177 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
THPO P40225 1/20 0.41
CA2 P00918 1/20 0.41
CYP3A4 P08684 1/20 0.41
CA5A P35218 1/20 0.41
CA9 Q16790 1/20 0.41
ALOX15 P16050 1/20 0.38
GLA P06280 1/20 0.37
TAS2R38 P59533 1/20 0.36
ALDH1A1 P00352 2/20 0.33
OR51E2 Q9H255 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL15045 0.84
SCHEMBL27524722 0.84 CRBN (0.60) CRBNLMNATSHRNFKB1BLM
SCHEMBL27939070 0.84 CRBN (0.60) CRBNLMNATSHRNFKB1BLM
SCHEMBL27560286 0.84 CRBN (0.60) CRBNLMNATSHRNFKB1BLM
SCHEMBL6344895 0.84 CRBN (0.48) CRBNLMNATSHRNFKB1BLM
SCHEMBL9475145 0.81
Hydrochloric Acid SCHEMBL5583405 0.81
Urea SCHEMBL4666861 0.81 CRBN (0.56) CRBNLMNATSHRNFKB1BLM
Urea SCHEMBL1497927 0.81 CRBN (0.56) CRBNLMNATSHRNFKB1BLM
Water SCHEMBL7642577 0.81

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-104478890-B A kind of all-trans-retinoic acid-camptothecin cancer therapy drug conjugate and its preparation method and application 浙江大学 2016-09-14 CN claimed
CN-114870828-B Honeycomb stone cerium-loaded composite denitration agent and preparation method and application thereof 安徽中环环保科技股份有限公司 2023-04-25 CN disclosed
CN-109576811-A A kind of modified synthetic fibers composition 福建省银河服饰有限公司 2019-04-05 CN disclosed
CN-106750296-B A kind of modified graphene/polyimides heat-conductive composite material and preparation method thereof 西北工业大学 2019-03-22 CN disclosed
CN-105997943-B A kind of nano particle and its preparation method and application of human serum albumins load camptothecine 浙江大学 2019-02-26 CN disclosed
CN-107243336-A Chromatography medium, preparation method and application thereof 大连理工大学 2017-10-13 CN disclosed
CN-105001426-B A kind of polyaminoacid graft copolymer with tumor-targeting and preparation method thereof 中国科学院长春应用化学研究所 2017-07-07 CN disclosed
CN-102850436-B GHRP 益普生制药股份有限公司 2017-06-16 CN disclosed
CN-106750296-A A kind of modified graphene/polyimides heat-conductive composite material and preparation method thereof 西北工业大学 2017-05-31 CN disclosed