Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL12760812 | 0.86 | ALDH1A1 (0.46) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL10775380 | 0.86 | ALDH1A1 (0.49) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL28381197 | 0.86 | ALDH1A1 (0.58) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL8984221 | 0.86 | ALDH1A1 (0.58) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| Phosphine SCHEMBL27943782 | 0.84 | ALDH1A1 (0.57) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL8433927 | 0.84 | HRH3 (0.48) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL8432421 | 0.84 | HRH3 (0.48) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL31680864 | 0.83 | CYP19A1 (0.57) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL31499382 | 0.82 | ALDH1A1 (0.43) | ALDH1A1LMNANFE2L2HPGDCYP19A1 | |
| SCHEMBL28936351 | 0.82 | ALDH1A1 (0.43) | ALDH1A1LMNANFE2L2HPGDCYP19A1 |
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-5292913-A | Labeling with deuterium or tritium | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1994-03-08 | — | — | US | disclosed |
| EP-0262227-B1 | PROCESS FOR THE PREPARATION OF MYOINOSITOL DERIVATIVES | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1993-01-20 | — | — | EP | disclosed |
| US-4952717-A | Myoinositol derivatives and preparation process thereof | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1990-08-28 | — | — | US | disclosed |
| EP-0262227-A1 | Process for the preparation of myoinositol derivatives | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1988-04-06 | — | — | EP | disclosed |