Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.30 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.30 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.30 |
| ▸ | ABAT | P80404 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10067905 | 0.89 | CYP2A6 (0.35) | CYP2A6KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL10072582 | 0.73 | CYP2A6 (0.37) | CYP2A6KIF11ALDH1A1RAB9AKDM4E | |
| SCHEMBL4745713 | 0.68 | CYP2A6 (0.33) | CYP2A6 | |
| SCHEMBL3257311 | 0.67 | CYP2A6 (0.57) | CYP2A6KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL29957704 | 0.67 | CYP2A6 (0.57) | CYP2A6KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL9798242 | 0.65 | CYP2A6 (0.44) | CYP2A6KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL9883875 | 0.65 | KIF11 (0.42) | CYP2A6KIF11ALDH1A1RAB9AKDM4E | |
| SCHEMBL7726898 | 0.65 | RAB9A (0.48) | CYP2A6KIF11ALDH1A1RAB9APTGER4 | |
| SCHEMBL5617799 | 0.64 | ALDH1A1 (0.56) | CYP2A6KIF11ALDH1A1TSHRRAB9A | |
| SCHEMBL4102305 | 0.63 | ALDH1A1 (0.50) | CYP2A6KIF11ALDH1A1RAB9AKDM4E |
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 |