Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31370844 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRTP53RAB9AMAPT | |
| SCHEMBL8605929 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TSHRTP53RAB9AMAPT | |
| SCHEMBL755702 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTP53NPC1KMT2A | |
| SCHEMBL755703 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTP53NPC1KMT2A | |
| SCHEMBL7402365 | 0.78 | ALDH1A1 (0.43) | ALDH1A1HSD17B10TSHRNPC1POLB | |
| SCHEMBL29888718 | 0.78 | KMT2A (0.49) | ALDH1A1MAPK1TSHRTP53NPC1 | |
| SCHEMBL7806144 | 0.78 | KMT2A (0.43) | NPC1KMT2ATDP1HDAC3HDAC4 | |
| SCHEMBL7806141 | 0.78 | KMT2A (0.43) | NPC1KMT2ATDP1HDAC3HDAC4 | |
| SCHEMBL7801107 | 0.78 | ALDH1A1 (0.43) | ALDH1A1HSD17B10TSHRNPC1POLB | |
| Hydrochloric Acid SCHEMBL8226909 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TSHRTP53NPC1KMT2A |
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-2003080736-A1 | USE OF OXAZINE DYES AS MARKING GROUPS FOR SINGLE MOLECULE ANALYSIS | GNOTHIS HOLDING SA (CH) | 2003-10-02 | — | — | WO | disclosed |