Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 7/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | TACR2 | P21452 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1830052 | 0.93 | ESR1 (0.47) | ESR1CNR2ALDH1A1HSD17B3ESR2 | |
| SCHEMBL7182118 | 0.93 | ESR1 (0.47) | ESR1CNR2ALDH1A1HSD17B3ESR2 | |
| SCHEMBL6295458 | 0.87 | ESR1 (0.50) | ESR1NPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL12352208 | 0.84 | CNR2 (0.47) | ESR1CNR2NPC1RAB9AESR2 | |
| SCHEMBL8910873 | 0.82 | CA12 (0.43) | ESR1CNR2NPC1RAB9AALDH1A1 | |
| SCHEMBL7173222 | 0.81 | ESR1 (0.58) | ESR1CNR2ALDH1A1HSD17B3ESR2 | |
| SCHEMBL7179930 | 0.81 | HSD17B1 (0.51) | ESR1CNR2ALDH1A1ESR2CYP3A4 | |
| SCHEMBL6295931 | 0.80 | ESR1 (0.58) | ESR1CNR2ALDH1A1L3MBTL1HSD17B3 | |
| SCHEMBL8632791 | 0.79 | GSK3B (0.44) | CNR2NPC1RAB9AHSD17B3KDM4E | |
| SCHEMBL21765905 | 0.77 | MAPT (0.45) | ESR1NPC1RAB9AALDH1A1L3MBTL1 |
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 3 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 |