Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | RXRA | P19793 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10866880 | 0.87 | KMT2A (0.62) | NPC1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL33368 | 0.86 | NPC1 (0.77) | NPC1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL28360958 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| Hydrochloric Acid SCHEMBL1982376 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| Ethane SCHEMBL3767932 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL10626135 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL2271443 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL1552312 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 | |
| Benzene SCHEMBL5410809 | 0.84 | ALDH1A1 (0.52) | NPC1KMT2AMEN1ALDH1A1KDM4E | |
| Ammonia Solution, Strong SCHEMBL28138417 | 0.84 | NPC1 (0.74) | NPC1KMT2AMEN1POLBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005105730-A2 | METHOD OF PREPARING AN ALCOHOL FROM A HALOGENOAROMATIC COMPOUND AND AN ALDEHYDE | SHASUN PHARMA SOLUTIONS LIMITED (GB) | 2005-11-10 | — | — | WO | disclosed |