Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL31590141 | 0.82 | KDM4E (0.32) | TSHRACHEMEN1KMT2AKDM4E | |
| SCHEMBL28823591 | 0.82 | KDM4E (0.32) | TSHRACHEMEN1KMT2AKDM4E | |
| SCHEMBL9319622 | 0.78 | TDP1 (0.37) | CYP1A2CYP2A6LMNATSHRALOX12 | |
| SCHEMBL28040846 | 0.77 | CYP1A2 (0.40) | CYP1A2CYP2A6FFAR4LMNATSHR | |
| SCHEMBL989764 | 0.75 | TRPA1 (0.38) | CYP1A2CYP2A6LMNATSHRALOX12 | |
| SCHEMBL28040349 | 0.73 | ACHE (0.43) | CYP1A2CYP2A6FFAR4LMNATSHR | |
| SCHEMBL27871135 | 0.73 | — | — | |
| SCHEMBL28040867 | 0.72 | TSHR (0.37) | CYP1A2CYP2A6LMNATSHRALOX12 | |
| SCHEMBL988389 | 0.72 | KDM4E (0.34) | LMNATSHRALOX12ACHEMEN1 | |
| SCHEMBL28040456 | 0.72 | TSHR (0.33) | LMNATSHRALOX12ACHEALDH1A1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102666561-B | Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2015-11-25 | — | — | CN | disclosed |