Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | CYTH2 | Q99418 | 1/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27986526 | 0.79 | ALDH1A1 (0.40) | KDM4EMAPTALDH1A1SMN1; SMN2GAA | |
| SCHEMBL17137317 | 0.71 | ALDH1A1 (0.49) | KDM4EMAPTALDH1A1GAALMNA | |
| SCHEMBL20081720 | 0.69 | CA12 (0.44) | KDM4EMAPTALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL18402598 | 0.69 | KDM4E (0.43) | KDM4EMAPTALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL776304 | 0.68 | HTR6 (0.46) | KDM4EALDH1A1SMN1; SMN2PSIP1HTR6 | |
| SCHEMBL20082066 | 0.63 | KDM4E (0.42) | KDM4EMAPTALDH1A1SMN1; SMN2RAB9A | |
| SCHEMBL8957794 | 0.61 | TSHR (0.43) | KDM4EMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL3043904 | 0.61 | SUMO2 (0.44) | KDM4EMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL836649 | 0.60 | — | — | |
| SCHEMBL4725712 | 0.60 | — | — |
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-103373911-B | Single fluoro cyclopropanes compound and its preparation method and application | 中国科学院上海有机化学研究所 | 2016-12-14 | — | — | CN | disclosed |
| CN-104119246-A | Cyclopropane derivatives, and preparation method and application thereof | SHANGHAI INST ORGANIC CHEM | 2014-10-29 | — | — | CN | disclosed |