Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL265848 | 1.00 | KMT2A (0.39) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| SCHEMBL498527 | 1.00 | KMT2A (0.39) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| SCHEMBL28843554 | 1.00 | KMT2A (0.39) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| SCHEMBL15575 | 1.00 | KMT2A (0.39) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| Methane SCHEMBL20636774 | 0.97 | KMT2A (0.37) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| Methane SCHEMBL1877115 | 0.97 | KMT2A (0.37) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| Methylcyclopentane SCHEMBL3876187 | 0.97 | CA1 (0.36) | KMT2AEPHX1ALDH1A1CA1CA2 | |
| SCHEMBL7171087 | 0.88 | TSHR (0.41) | KMT2AEPHX1ALDH1A1 | |
| Acetic Acid SCHEMBL28484765 | 0.88 | EPHX1 (0.41) | KMT2AEPHX1ALDH1A1 | |
| Carbimide SCHEMBL471891 | 0.88 | ACHE (0.37) | KMT2AEPHX1ALDH1A1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0378895-B1 | A MERCAPTO COMPOUND, A HIGH REFRACTIVE INDEX RESIN AND LENS AND A PROCESS FOR PREPARING THEM | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-07-14 | — | — | EP | disclosed |
| US-5191055-A | Polythiourethanes | MITSUI TOATSU CHEMICALS, INC. (JP) | 1993-03-02 | — | — | US | disclosed |
| US-5087758-A | Polythiourethane monomer | MITSUI TOATSU CHEMICALS, INC. (JP) | 1992-02-11 | — | — | US | disclosed |
| EP-0378895-A1 | A mercapto compound, a high refractive index resin and lens and a process for preparing them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1990-07-25 | — | — | EP | disclosed |