Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 5/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3282883 | 0.75 | KCNN4 (0.45) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL13889921 | 0.71 | KCNN4 (0.41) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL28642382 | 0.71 | KCNN4 (0.41) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL3227998 | 0.71 | KCNN4 (0.48) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL5079101 | 0.71 | KCNN4 (0.41) | KCNN4MAPK1ALDH1A1TSHRALOX15 | |
| SCHEMBL1203968 | 0.71 | KCNN4 (0.41) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL11322826 | 0.70 | KCNN4 (0.37) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL896502 | 0.70 | MAPK1 (0.42) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL686328 | 0.69 | MAPK1 (0.52) | KCNN4MAPK1ALDH1A1TSHRTAAR1 | |
| SCHEMBL23665855 | 0.65 | KCNN4 (0.36) | KCNN4MAPK1ALDH1A1TSHRTAAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110669058-A | Tricyclic quinolone carboxylic acid and preparation method thereof | 江西农业大学 | 2020-01-10 | — | — | CN | claimed |
| CN-110669058-A | Tricyclic quinolone carboxylic acid and preparation method thereof | 江西农业大学 | 2020-01-10 | — | — | CN | disclosed |
| US-5321032-A | Peptide compounds and pharmaceutical compositions thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-14 | — | — | US | disclosed |
| EP-0515681-A1 | PEPTIDE COMPOUND | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-12-02 | — | — | EP | disclosed |