Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27946321 | 0.81 | CYP1A2 (0.36) | CYP1A2CYP2A6IDO1NQO2TDP1 | |
| SCHEMBL9463221 | 0.75 | TDP1 (0.44) | CYP1A2CYP2A6IDO1NQO2MAOA | |
| SCHEMBL12879287 | 0.71 | LMNA (0.39) | CYP1A2CYP2A6IDO1NQO2MAOA | |
| SCHEMBL2016957 | 0.71 | TRPA1 (0.54) | CYP1A2CYP2A6IDO1TDP1TP53 | |
| SCHEMBL27946340 | 0.71 | IDO1 (0.38) | IDO1ALDH1A1 | |
| SCHEMBL18238786 | 0.71 | ELANE (0.40) | CYP1A2CYP2A6IDO1SMN1; SMN2KDM4E | |
| SCHEMBL28033237 | 0.70 | TDP1 (0.44) | CYP1A2CYP2A6NQO2TDP1TP53 | |
| SCHEMBL27946342 | 0.70 | — | — | |
| SCHEMBL12817487 | 0.70 | CYP1A2 (0.35) | CYP1A2CYP2A6IDO1NQO2MAOA | |
| SCHEMBL12816335 | 0.70 | CYP1A2 (0.35) | CYP1A2CYP2A6IDO1NQO2MAOA |
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-103459406-B | For the preparation of the method for transition metal complex, for the catalyzer of trimerization, for the preparation of the method for 1-hexene, for the preparation of the method (2) of the cyclopentadiene compound replaced | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2016-03-16 | — | — | CN | disclosed |
| CN-103459406-A | Method for producing the transition metal complex, catalyst for trimerization, method for producing 1-hexene, method for producing the substituted cyclopentadiene compound (2) | SUMITOMO CHEMICAL CO | 2013-12-18 | — | — | CN | disclosed |