Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.83 |
| ▸ | HPGD | P15428 | 2/20 | 0.83 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.83 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.83 |
| ▸ | STK4 | Q13043 | 1/20 | 0.47 |
| ▸ | STK3 | Q13188 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9134098 | 0.91 | ALDH1A1 (0.80) | ALDH1A1HPGDALOX15HSD17B10STK4 | |
| SCHEMBL9133599 | 0.91 | ALDH1A1 (0.80) | ALDH1A1HPGDALOX15HSD17B10KDM4E | |
| SCHEMBL8966838 | 0.91 | ALDH1A1 (1.00) | ALDH1A1HPGDALOX15HSD17B10KDM4E | |
| SCHEMBL8923375 | 0.84 | ALDH1A1 (0.63) | ALDH1A1HPGDALOX15HSD17B10STK4 | |
| SCHEMBL9132104 | 0.81 | ALDH1A1 (0.65) | ALDH1A1HPGDALOX15HSD17B10MEN1 | |
| SCHEMBL9135743 | 0.80 | ALDH1A1 (0.63) | ALDH1A1HPGDALOX15HSD17B10MEN1 | |
| SCHEMBL5675180 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HPGDALOX15HSD17B10STK4 | |
| SCHEMBL8921445 | 0.79 | HPGD (0.62) | ALDH1A1HPGDALOX15HSD17B10STK4 | |
| SCHEMBL27395864 | 0.79 | ALDH1A1 (0.79) | ALDH1A1HPGDALOX15HSD17B10STK4 | |
| SCHEMBL9131341 | 0.79 | ALDH1A1 (0.62) | ALDH1A1HPGDALOX15HSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5684160-A | 3-aminopyrroles, methods for their synthesis and for their pharmaceutical use | ARZNEIMETTELWERK DRESDEN GMBH (DE) | 1997-11-04 | — | — | US | disclosed |
| US-5502051-A | CENTRAL NERVOUS SYSTEM, ANTISPASMODIC | ARZNEIMITTELWERK DRESDEN GMBH (DE) | 1996-03-26 | — | — | US | disclosed |