Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TACR3 | P29371 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9569932 | 0.82 | ADORA2A (0.58) | ADORA2AADORA1ALDH1A1HPGDKDM4E | |
| SCHEMBL9569905 | 0.74 | PTGER4 (0.54) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL9570003 | 0.74 | HPGD (0.60) | HPGDMAPK8KMT2ANPC1 | |
| SCHEMBL247742 | 0.74 | HSD17B10 (0.63) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL2672977 | 0.74 | HSD17B10 (0.63) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL249524 | 0.74 | HSD17B10 (0.63) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL12461860 | 0.73 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL16348943 | 0.73 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL10905733 | 0.72 | ALDH1A1 (0.56) | ADORA2AADORA1ALDH1A1HPGDKDM4E | |
| SCHEMBL9718520 | 0.72 | HSD17B10 (0.61) | ALDH1A1HPGDKDM4EHSD17B10LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0550900-A1 | Herbicidal and plant-nematocidal compositions based on mercaptonicotinic acid derivatives | BAYER AG (DE) | 1993-07-14 | — | — | EP | disclosed |