Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 2/20 | 0.32 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL317298 | 0.76 | RAPGEF4 (0.33) | RAPGEF4 | |
| SCHEMBL6293603 | 0.75 | — | — | |
| SCHEMBL513951 | 0.70 | CYP3A4 (0.40) | ALDH1A1CYP3A4RAPGEF4 | |
| SCHEMBL7009262 | 0.70 | RAPGEF4 (0.54) | ALDH1A1CYP3A4TSHRRECQLHSD17B10 | |
| SCHEMBL7010337 | 0.70 | — | — | |
| SCHEMBL491447 | 0.69 | — | — | |
| SCHEMBL2937097 | 0.68 | TSHR (0.67) | ALDH1A1CYP3A4TSHRRECQLHSD17B10 | |
| SCHEMBL2018625 | 0.67 | MAPT (0.35) | ALDH1A1 | |
| SCHEMBL20558709 | 0.66 | TSHR (0.41) | ALDH1A1CYP3A4TSHRRECQLHSD17B10 | |
| SCHEMBL11487737 | 0.66 | CYP1A2 (0.41) | ALDH1A1TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0775702-B1 | NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF | TOYAMA CHEMICAL CO LTD (JP) | 2003-07-23 | — | — | EP | disclosed |
| US-5935952-A | ANTIBACTERIAL AGENT | TOYAMA CHEMICAL CO., LTD. (JP) | 1999-08-10 | — | — | US | disclosed |
| EP-0775702-A1 | NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF | TOYAMA CHEMICAL CO., LTD. (JP) | 1997-05-28 | — | — | EP | disclosed |