Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4745708 | 0.89 | CYP2A6 (0.36) | CYP2A6KIF11ALDH1A1TSHRKDM4E | |
| SCHEMBL4448546 | 0.74 | CYP2A6 (0.36) | CYP2A6KIF11ALDH1A1KDM4EPTGS2 | |
| SCHEMBL9127399 | 0.73 | CYP2A6 (0.48) | CYP2A6KIF11ALDH1A1TSHRKDM4E | |
| SCHEMBL10067907 | 0.71 | — | — | |
| SCHEMBL9670965 | 0.69 | CYP1A2 (0.57) | CYP2A6KIF11ALDH1A1TSHR | |
| SCHEMBL29953349 | 0.69 | CYP1A2 (0.57) | CYP2A6KIF11ALDH1A1TSHR | |
| SCHEMBL4441288 | 0.69 | CYP2A6 (0.32) | CYP2A6 | |
| SCHEMBL9798242 | 0.68 | CYP2A6 (0.44) | CYP2A6KIF11ALDH1A1TSHRKDM4E | |
| SCHEMBL977774 | 0.66 | CYP2A6 (0.54) | CYP2A6ALDH1A1TSHRKDM4EPTGS2 | |
| SCHEMBL5618062 | 0.65 | ALDH1A1 (0.54) | CYP2A6KIF11ALDH1A1TSHRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2447775-A1 | Resist underlayer film composition and patterning process using the same | Shin-Etsu Chemical Co., Ltd. (JP) | 2012-05-02 | — | — | EP | disclosed |