Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17653955 | 0.86 | ACHE (0.50) | ACHETSHRBLMNPSR1ALDH1A1 | |
| SCHEMBL3315336 | 0.85 | AKR1C3 (0.56) | ACHETSHRBLMNPSR1ALDH1A1 | |
| SCHEMBL8034561 | 0.78 | ALDH1A1 (0.55) | ACHETSHRBLMNPSR1ALDH1A1 | |
| SCHEMBL13172093 | 0.78 | ALDH1A1 (0.47) | ACHETSHRBLMNPSR1ALDH1A1 | |
| SCHEMBL1597428 | 0.77 | ALDH1A1 (0.59) | TSHRBLMALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL7610341 | 0.77 | AKR1C3 (0.49) | ACHETSHRBLMNPSR1ALDH1A1 | |
| SCHEMBL3314391 | 0.77 | MT-CO2 (0.50) | ACHETSHRALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL5132140 | 0.77 | ALDH1A1 (0.53) | ACHETSHRBLMALDH1A1CYP3A4 | |
| SCHEMBL11466249 | 0.76 | ALDH1A1 (0.57) | ACHETSHRALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL84557 | 0.76 | ALDH1A1 (0.57) | ACHETSHRALDH1A1CYP3A4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0502278-B1 | Polycyclic dyes | ZENECA LTD (GB) | 1997-03-05 | — | — | EP | disclosed |
| US-5374724-A | Process for the preparation of substituted acetic acids | ZENECA, LIMITED (GB) | 1994-12-20 | — | — | US | disclosed |
| US-5189181-A | Process for preparation 2,6-dihydrobenzo[1:26, 4:5-6]-difuran dyes | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-02-23 | — | — | US | disclosed |
| EP-0502278-A1 | Polycyclic dyes | ZENECA LIMITED (GB) | 1992-09-09 | — | — | EP | disclosed |