Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | SUMO2 | P61956 | 1/20 | 0.36 |
| ▸ | SUMO1 | P63165 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP3 | Q9H4L4 | 1/20 | 0.36 |
| ▸ | SENP2 | Q9HC62 | 1/20 | 0.36 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7032447 | 0.96 | CYP3A4 (0.48) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL428347 | 0.92 | CYP3A4 (0.42) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL1755154 | 0.88 | BRD4 (0.49) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL10870494 | 0.87 | TTR (0.43) | CYP3A4TSHRTP53BRD4CREBBP | |
| SCHEMBL9515282 | 0.85 | CD44 (0.44) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL7908182 | 0.85 | CYP3A4 (0.44) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL6938187 | 0.85 | CYP3A4 (0.44) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL427123 | 0.85 | TTR (0.45) | CYP3A4TSHRALDH1A1HSD17B10ALOX15 | |
| SCHEMBL1805633 | 0.83 | BRD4 (0.53) | CYP3A4TSHRMAPK1TP53BRD4 | |
| SCHEMBL31697699 | 0.83 | BRD4 (0.49) | TP53BRD4CREBBPALDH1A1HSD17B10 |
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-0652262-B1 | Reactive dyestuffs, their preparation and use | BAYER AG (DE) | 2000-07-12 | — | — | EP | disclosed |
| EP-0652262-A1 | Reactive dyestuffs, their preparation and use | BAYER AG (DE) | 1995-05-10 | — | — | EP | disclosed |