Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.49 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.49 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 4/20 | 0.47 |
| ▸ | DRD1 | P21728 | 4/20 | 0.47 |
| ▸ | DRD4 | P21917 | 4/20 | 0.47 |
| ▸ | DRD5 | P21918 | 4/20 | 0.47 |
| ▸ | DRD3 | P35462 | 4/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4102267 | 0.91 | NOTUM (0.57) | ALDH1A1HSD17B10KMT2AMEN1NOTUM | |
| SCHEMBL2616321 | 0.78 | HSD17B10 (0.60) | ALDH1A1HSD17B10KMT2AMEN1NOTUM | |
| SCHEMBL12061308 | 0.77 | HRH3 (0.62) | ALDH1A1HSD17B10KMT2AMEN1NOTUM | |
| SCHEMBL7261315 | 0.76 | HSD17B10 (0.62) | HSD17B10KMT2AMEN1NOTUMPDK1 | |
| SCHEMBL7733872 | 0.76 | ALDH1A1 (0.67) | ALDH1A1NOTUMPDK1PDK2PDK3 | |
| SCHEMBL21524785 | 0.76 | HSD17B10 (0.58) | HSD17B10KMT2AMEN1NOTUMPDK1 | |
| SCHEMBL13531815 | 0.76 | MEN1 (0.66) | HSD17B10KMT2AMEN1NOTUMPDK1 | |
| SCHEMBL1177380 | 0.76 | HSD17B10 (0.58) | HSD17B10KMT2AMEN1NOTUMPDK1 | |
| SCHEMBL1177381 | 0.76 | HSD17B10 (0.58) | HSD17B10KMT2AMEN1NOTUMPDK1 | |
| SCHEMBL2203840 | 0.75 | NOTUM (0.83) | ALDH1A1HSD17B10KMT2AMEN1NOTUM |
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-0529452-B1 | 1,7-Condensed 3-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them | SOLVAY PHARM GMBH (DE) | 1998-11-11 | — | — | EP | disclosed |
| US-5324725-A | Antiinflammatory agent, antiallergen | KALI-CHEMIE PHARMA GMBH (DE) | 1994-06-28 | — | — | US | disclosed |
| EP-0529452-A2 | 1,7-Condensed 2-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them | Kali-Chemie Pharma GmbH (DE) | 1993-03-03 | — | — | EP | disclosed |