Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | RHOA | P61586 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10774894 | 0.95 | TDP1 (0.42) | TDP1CYP3A4NPSR1TSHRALDH1A1 | |
| SCHEMBL1250345 | 0.87 | CYP3A4 (0.50) | CYP3A4NPSR1TSHRALDH1A1HSD17B10 | |
| SCHEMBL10775099 | 0.82 | TDP1 (0.44) | TDP1CYP3A4NPSR1TSHRALDH1A1 | |
| SCHEMBL10778176 | 0.81 | CYP3A4 (0.52) | CYP3A4NPSR1TSHRALDH1A1HSD17B10 | |
| SCHEMBL11044588 | 0.81 | CYP3A4 (0.44) | CYP3A4NPSR1TSHRALDH1A1HSD17B10 | |
| SCHEMBL10781128 | 0.81 | TDP1 (0.42) | TDP1CYP3A4NPSR1TSHRALDH1A1 | |
| Methane SCHEMBL11118720 | 0.80 | CYP3A4 (0.50) | CYP3A4NPSR1TSHRALDH1A1HSD17B10 | |
| SCHEMBL10775068 | 0.76 | TSHR (0.33) | TSHRALDH1A1 | |
| SCHEMBL10870361 | 0.75 | SNCA (0.54) | TDP1CYP3A4NPSR1TSHRALDH1A1 | |
| SCHEMBL8519916 | 0.75 | CYP3A4 (0.46) | CYP3A4TSHRALDH1A1HSD17B10PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0112927-B1 | RESIN FOR LENS WITH HIGH REFRACTIVE INDEX AND LENS COMPOSED OF IT | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1987-02-11 | — | — | EP | disclosed |
| US-4522993-A | COPOLYMER HAVING UNITS FROM A BIS-ALLYL HALOGENATED BENZENE DICARBOXYLATE | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1985-06-11 | — | — | US | disclosed |
| EP-0112927-A1 | RESIN FOR LENS WITH HIGH REFRACTIVE INDEX AND LENS COMPOSED OF IT | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-07-11 | — | — | EP | disclosed |