Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 12/20 | 0.67 |
| ▸ | NPC1 | O15118 | 11/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.63 |
| ▸ | HPGD | P15428 | 9/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | ATR | Q13535 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.56 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.56 |
| ▸ | RELA | Q04206 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.53 |
| ▸ | CHUK | O15111 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27604284 | 1.00 | RAB9A (0.67) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL6450028 | 0.98 | RAB9A (0.69) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27620651 | 0.96 | RAB9A (0.68) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27628825 | 0.96 | RAB9A (0.67) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL28038904 | 0.96 | RAB9A (0.67) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27477883 | 0.95 | RAB9A (0.69) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27620643 | 0.93 | RAB9A (0.68) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL9737555 | 0.88 | NPC1 (0.64) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27620648 | 0.86 | ALDH1A1 (0.68) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27655878 | 0.86 | NPC1 (0.68) | RAB9ANPC1ALDH1A1KDM4EHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070107835-A1 | ETHYNYL CONTAINING ELECTRON TRANSPORT DYES AND COMPOSITIONS | 3M INNOVATIVE PROPERTIES COMPANY | 2007-05-17 | — | — | US | disclosed |
| US-7192657-B2 | Ethynyl containing electron transport dyes and compositions | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-03-20 | — | — | US | disclosed |
| US-20040214037-A1 | Ethynyl containing electron transport dyes and compositions | 3M INNOVATIVE PROPERTIES COMPANY | 2004-10-28 | — | — | US | disclosed |