Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 14/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL13625208 | 0.85 | ACHE (0.39) | ACHEMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL7904671 | 0.81 | ACHE (0.49) | ACHEALDH1A1EPHX1 | |
| SCHEMBL16145882 | 0.80 | ACHE (0.50) | ACHEALDH1A1EPHX1 | |
| SCHEMBL7897322 | 0.79 | CYP2C9 (0.39) | ALDH1A1EPHX1CYP2C9CYP2C19 | |
| SCHEMBL16145641 | 0.76 | ACHE (0.53) | ACHEEPHX1 | |
| SCHEMBL13625207 | 0.75 | EPHX1 (0.43) | EPHX1 | |
| SCHEMBL30059386 | 0.75 | ACHE (0.49) | ACHEALDH1A1EPHX1 | |
| SCHEMBL16145948 | 0.74 | ACHE (0.47) | ACHEEPHX1 | |
| SCHEMBL30276599 | 0.74 | ACHE (0.47) | ACHEALDH1A1EPHX1 | |
| SCHEMBL28230284 | 0.73 | ACHE (0.50) | ACHEEPHX1 |
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-6204409-B1 | RAW MATERIAL FOR BLOCK ISOCYANATE, DIISOCYANATE, DEVELOPING AGENT FOR THERMOSENSIBLE PAPER, POWDER PAINT AND THE LIKE | MITSUI CHEMICALS, INC. (JP) | 2001-03-20 | — | — | US | disclosed |
| EP-0990644-A1 | NOVEL URETHANE COMPOUNDS AND PROCESS FOR PRODUCING POLYCYCLIC ALIPHATIC DIISOCYANATE | Mitsui Chemicals, Inc. (JP) | 2000-04-05 | — | — | EP | disclosed |