Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Oxazolidine SCHEMBL27483016 | 0.86 | TDP1 (0.43) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Morpholine SCHEMBL21145317 | 0.86 | KMT2A (0.50) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Morpholine SCHEMBL22500932 | 0.84 | MEN1 (0.48) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Morpholine SCHEMBL22501136 | 0.84 | KDM4E (0.48) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Piperazine SCHEMBL27871604 | 0.82 | TDP1 (0.62) | KMT2AKDM4ETDP1TSHRPOLB | |
| Dioxane SCHEMBL11782030 | 0.82 | TDP1 (0.62) | KDM4ETDP1HTTTSHRPOLB | |
| Morpholine SCHEMBL27737341 | 0.79 | GAA (0.61) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Morpholine SCHEMBL1121824 | 0.79 | — | — | |
| Morpholine SCHEMBL28279707 | 0.79 | MEN1 (0.61) | KMT2AMEN1KDM4EGAACYP2C9 | |
| Morpholine SCHEMBL456806 | 0.79 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104936944-B | It is used as the dihydroindole ketone derivate of tyrosine kinase inhibitor | 山东亨利医药科技有限责任公司 | 2017-09-12 | — | — | CN | disclosed |
| CN-105358556-A | Novel compounds for selective histone deacetylase inhibitors, and pharmaceutical composition comprising the same | CHONG KUN DANG PHARM CORP | 2016-02-24 | — | — | CN | disclosed |