Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL8803824 | 0.80 | CYP2D6 (0.41) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL9468717 | 0.80 | CYP2D6 (0.44) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL15438087 | 0.79 | ACHE (0.37) | TSHRPOLBNPC1 | |
| SCHEMBL365852 | 0.77 | CYP3A4 (0.39) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL16761022 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL14878497 | 0.77 | ALDH1A1 (0.41) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL238384 | 0.76 | — | — | |
| SCHEMBL2992668 | 0.76 | ALDH1A1 (0.40) | ALDH1A1HSD17B10LMNAALOX15TSHR | |
| SCHEMBL3470406 | 0.75 | MAPT (0.35) | TSHRTDP1MAPTCHRM1 | |
| SCHEMBL2989633 | 0.74 | POLB (0.41) | ALDH1A1HSD17B10LMNAALOX15TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102780038-A | Nonaqueous electrolyte battery | MITSUBISHI CHEM CORP | 2012-11-14 | — | — | CN | disclosed |
| CN-101622751-A | Nonaqueous electrolyte solution and nonaqueous electrolyte battery | MITSUBISHI CHEM CORP | 2010-01-06 | — | — | CN | disclosed |