Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | DAO | P14920 | 1/20 | 0.43 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.42 |
| ▸ | FCER2 | P06734 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL113636 | 0.82 | ALDH1A1 (0.53) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL29873370 | 0.82 | ALDH1A1 (0.53) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL26854390 | 0.79 | ALDH1A1 (0.50) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL5778919 | 0.77 | GLO1 (0.37) | ALDH1A1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL28308974 | 0.76 | ACACB (0.45) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL934232 | 0.76 | FCER2 (0.53) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL4049830 | 0.75 | ALDH1A1 (0.46) | ALDH1A1NPC1POLBRAB9ADAO | |
| SCHEMBL27620527 | 0.75 | NPC1 (0.52) | ACACBALDH1A1NPC1POLBRAB9A | |
| SCHEMBL2297609 | 0.74 | PKM (0.55) | ACACBALDH1A1NPC1POLBMAPT | |
| SCHEMBL5783367 | 0.74 | PKM (0.55) | ACACBALDH1A1NPC1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1635829-A1 | 8-(3-BIARYL)PHENYLQUINOLINE PHOSPHODIESTERASE-4-INHIBITORS | Merck Frosst Canada Ltd. (CA) | 2006-03-22 | — | — | EP | claimed |
| WO-2004096220-A1 | 8-(3-BIARYL)PHENYLQUINOLINE PHOSPHODIESTERASE-4-INHIBITORS | MERCK FROSST CANADA LTD. (CA) | 2004-11-11 | — | — | WO | claimed |