Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL5052581 | 0.92 | SLC6A4 (0.37) | SLC6A4KDM4EHSD17B10AR | |
| SCHEMBL5051548 | 0.90 | SLC6A4 (0.36) | SLC6A4KDM4EHSD17B10AR | |
| SCHEMBL5051482 | 0.79 | SLC6A4 (0.32) | SLC6A4 | |
| SCHEMBL14189682 | 0.78 | HSD17B10 (0.35) | SLC6A4HSD17B10 | |
| SCHEMBL5052526 | 0.76 | MGAM (0.34) | — | |
| SCHEMBL7937564 | 0.75 | SLC6A4 (0.45) | SLC6A4KDM4EHSD17B10ARALDH1A1 | |
| SCHEMBL4159679 | 0.74 | TTR (0.32) | — | |
| SCHEMBL12762364 | 0.71 | KIF11 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL10300260 | 0.71 | ALDH1A1 (0.32) | ALDH1A1TDP1 | |
| SCHEMBL5051483 | 0.70 | ALDH1A1 (0.42) | SLC6A4KDM4EHSD17B10ARALDH1A1 |
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-20080138635-A1 | Conjugated Organic Molecules for Molecular Electronic Devices | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2008-06-12 | — | — | US | disclosed |
| US-20080138635-A1 | Conjugated Organic Molecules for Molecular Electronic Devices | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2008-06-12 | — | — | US | disclosed |
| WO-2006093467-A1 | CONJUGATED ORGANIC MOLECULES FOR MOLECULAR ELECTRONIC DEVICES | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2006-09-08 | — | — | WO | disclosed |