Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | CASP6 | P55212 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SENP2 | Q9HC62 | 4/20 | 0.39 |
| ▸ | SUMO2 | P61956 | 3/20 | 0.39 |
| ▸ | SUMO1 | P63165 | 3/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.39 |
| ▸ | SENP3 | Q9H4L4 | 3/20 | 0.39 |
| ▸ | SENP1 | Q9P0U3 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10704767 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL11374505 | 0.86 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL9477802 | 0.84 | HSD17B10 (0.48) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL9274363 | 0.83 | TTR (0.66) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL30639252 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL30322685 | 0.82 | TTR (0.68) | ALDH1A1TTRTDP1MEN1THRB | |
| SCHEMBL1146228 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL313372 | 0.82 | TTR (0.68) | ALDH1A1TTRTDP1MEN1THRB | |
| SCHEMBL7651109 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL29624161 | 0.82 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5128455-A | WATER-SOLUBLE FIBER-REACTIVE DYES, CONTAINING AN AMINO-SUBSTITUTED 5-TRIAZINE RING WITH A FIBER-REACTIVE GROUP OF THE VINYLSULFONE SERIES | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-07-07 | — | — | US | disclosed |