Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | UNG | P13051 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL15715521 | 0.94 | ALDH1A1 (0.36) | ALDH1A1CYP2A6KDM4EPTGS2RAB9A | |
| SCHEMBL14543753 | 0.82 | ALDH5A1 (0.42) | ALDH1A1KDM4EPTGS2RAB9AHSD17B10 | |
| SCHEMBL13893901 | 0.82 | ALDH1A1 (0.46) | ALDH1A1 | |
| SCHEMBL12527375 | 0.82 | HSD17B10 (0.42) | ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL12020866 | 0.82 | CYP2A6 (0.42) | ALDH1A1CYP2A6SRCTSHR | |
| SCHEMBL6856673 | 0.77 | ALDH1A1 (0.48) | ALDH1A1CYP2A6KDM4EPTGS2RAB9A | |
| SCHEMBL12187815 | 0.77 | GABRA1 (0.33) | — | |
| SCHEMBL8015706 | 0.77 | UNG (0.52) | ALDH1A1KDM4EHSD17B10TSHRUNG | |
| SCHEMBL8066514 | 0.77 | CES2 (0.34) | ALDH1A1 | |
| SCHEMBL308093 | 0.75 | ALDH1A1 (0.47) | ALDH1A1CYP2A6KDM4EPTGS2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-7537842-B2 | Asymmetric dendrimers | ISIS INNOVATION LIMITED (GB) | 2009-05-26 | — | — | US | disclosed |
| WO-2009051454-A2 | NOVEL COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME | CHEIL INDUSTRIES INC. (KR) | 2009-04-23 | — | — | WO | disclosed |