Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | NQO1 | P15559 | 2/20 | 0.33 |
| ▸ | POR | P16435 | 2/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918904 | 0.89 | ACHE (0.36) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL8918299 | 0.85 | PDK2 (0.38) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL8920583 | 0.83 | PDK2 (0.40) | ALDH1A1MEN1MAPTKMT2APDK2 | |
| SCHEMBL8920932 | 0.81 | PDE7A (0.38) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL8919366 | 0.79 | PDK2 (0.34) | PDK2 | |
| SCHEMBL8919192 | 0.77 | NPC1 (0.31) | ALDH1A1 | |
| SCHEMBL7817179 | 0.75 | MEN1 (0.40) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL7816525 | 0.75 | ALDH1A1 (0.31) | ALDH1A1MAPT | |
| SCHEMBL8920322 | 0.74 | ALDH1A1 (0.38) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL8921050 | 0.73 | MAOB (0.40) | MAPTPDK2ACHETSHR |
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-5691272-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-11-25 | — | — | US | disclosed |
| US-5559247-A | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1996-09-24 | — | — | US | disclosed |
| EP-0679640-A1 | Carboxylate and heat-sensitive recording material using same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1995-11-02 | — | — | EP | disclosed |