Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.67 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.66 |
| ▸ | CA12 | O43570 | 1/20 | 0.61 |
| ▸ | CA9 | Q16790 | 1/20 | 0.61 |
| ▸ | NR1H2 | P55055 | 4/20 | 0.60 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.58 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7811989 | 0.93 | CA12 (0.71) | NPC1RAB9ANR1I2CA12CA9 | |
| SCHEMBL5623176 | 0.90 | ALDH1A1 (0.71) | NPC1RAB9ANR1I2CA12CA9 | |
| SCHEMBL812702 | 0.86 | CA12 (0.78) | NR1I2CA12CA9NR1H2NR1H3 | |
| SCHEMBL18031174 | 0.84 | MAPT (0.82) | NPC1RAB9ACA12CA9L3MBTL1 | |
| SCHEMBL6302212 | 0.84 | MAPT (0.82) | NPC1RAB9ACA12CA9L3MBTL1 | |
| SCHEMBL11910521 | 0.83 | CA12 (0.86) | NR1I2CA12CA9NR1H2NR1H3 | |
| SCHEMBL13190025 | 0.83 | ALDH1A1 (0.62) | NPC1RAB9ACA12CA9L3MBTL1 | |
| SCHEMBL7175900 | 0.82 | ALDH1A1 (0.61) | NPC1RAB9ACA12CA9L3MBTL1 | |
| SCHEMBL7267942 | 0.82 | ALDH1A1 (0.61) | NPC1RAB9ANR1I2CA12CA9 | |
| SCHEMBL3718777 | 0.82 | NR1I2 (0.62) | NR1I2CA12CA9NR1H2NR1H3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6921740-B1 | Electron-receiving compound and thermal recording material | MITSUBISHI PAPER MIILS LTD. (JP) | 2005-07-26 | — | — | US | disclosed |
| US-6579829-B2 | Aromatic sulfonamide compound | MITSUI CHEMICALS, INC. (JP) | 2003-06-17 | — | — | US | disclosed |
| EP-1138517-A2 | Developer composition and heat sensitive recording material | Mitsui Chemicals, Inc. (JP) | 2001-10-04 | — | — | EP | disclosed |
| CN-1219927-A | Phenylalkylcarboxylic acid derivatives | SANKYO CO (JP) | 1999-06-16 | — | — | CN | disclosed |