Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.68 |
| ▸ | CA2 | P00918 | 5/20 | 0.68 |
| ▸ | CA9 | Q16790 | 5/20 | 0.68 |
| ▸ | NPC1 | O15118 | 4/20 | 0.68 |
| ▸ | MEN1 | O00255 | 4/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.68 |
| ▸ | RAB9A | P51151 | 3/20 | 0.68 |
| ▸ | POLB | P06746 | 2/20 | 0.68 |
| ▸ | F2 | P00734 | 3/20 | 0.59 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.59 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.59 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL15631068 | 0.91 | NPC1 (0.73) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL269293 | 0.86 | ALDH1A1 (0.73) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL1389306 | 0.86 | ALDH1A1 (0.73) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL11323350 | 0.86 | CA12 (0.73) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL14613041 | 0.85 | ALDH1A1 (0.72) | CA12CA2CA9NPC1MEN1 | |
| Hydrochloric Acid SCHEMBL10568616 | 0.84 | ALDH1A1 (0.70) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL15631072 | 0.83 | CA12 (0.63) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL42643 | 0.81 | CA2 (1.00) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL15631065 | 0.81 | CA12 (0.61) | CA12CA2CA9NPC1MEN1 | |
| SCHEMBL42659 | 0.81 | CA2 (1.00) | CA12CA2CA9NPC1MEN1 |
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-9006402-B2 | Quaternary data-storage materials and the preparation method thereof | ZHANGJIAGANG INSTITUTE OF INDUSTRIAL TECHNOLOGIES SOOCHOW UNIVERSITY (CN) | 2015-04-14 | — | — | US | disclosed |
| US-9006402-B2 | Quaternary data-storage materials and the preparation method thereof | ZHANGJIAGANG INSTITUTE OF INDUSTRIAL TECHNOLOGIES SOOCHOW UNIVERSITY (CN) | 2015-04-14 | — | — | US | disclosed |