Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | CASP1 | P29466 | 4/20 | 0.49 |
| ▸ | CASP7 | P55210 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | USP1 | O94782 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 4/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9686598 | 0.87 | HTT (0.51) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL8808269 | 0.84 | HTT (0.53) | ALDH1A1HSD17B10CYP1A2HPGDCASP1 | |
| SCHEMBL8810107 | 0.80 | CYP1A2 (0.55) | ALDH1A1HSD17B10CYP1A2HPGDCASP1 | |
| SCHEMBL9686754 | 0.80 | HTT (0.50) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| Fumaric Acid SCHEMBL8809775 | 0.76 | CYP1A2 (0.48) | ALDH1A1HSD17B10CYP1A2HPGDCASP1 | |
| Maleic Acid SCHEMBL8809763 | 0.76 | CYP1A2 (0.48) | ALDH1A1HSD17B10CYP1A2HPGDCASP1 | |
| SCHEMBL8810475 | 0.74 | LMNA (0.53) | ALDH1A1HPGDCASP1TSHRHTT | |
| SCHEMBL8811313 | 0.73 | HTR7 (0.44) | ALDH1A1HSD17B10HPGDTSHRHTT | |
| SCHEMBL8811787 | 0.71 | LMNA (0.55) | ALDH1A1HSD17B10HPGDCASP1TSHR | |
| SCHEMBL8810642 | 0.71 | HTT (0.52) | ALDH1A1HSD17B10HPGDCASP1TSHR |
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-0257102-B1 | AGENTS FOR TREATING NEUROPHATHY | MITSUI PETROCHEMICAL IND (JP) | 1997-11-19 | — | — | EP | disclosed |
| EP-0799617-A2 | Therapeutic agent for neurological diseases | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1997-10-08 | — | — | EP | disclosed |
| US-4959368-A | PYRIMIDINE DERIVATIVES | MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) | 1990-09-25 | — | — | US | disclosed |
| EP-0257102-A1 | AGENTS FOR TREATING NEUROPHATHY | Mitsui Chemicals, Inc. (JP) | 1988-03-02 | — | — | EP | disclosed |