Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA4 | P22748 | 3/20 | 0.38 |
| ▸ | CA6 | P23280 | 3/20 | 0.38 |
| ▸ | CA5A | P35218 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.38 |
| ▸ | F13A1 | P00488 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | THPO | P40225 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CASP2 | P42575 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9752430 | 1.00 | TSHR (0.43) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL13016325 | 0.97 | GBA1 (0.41) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL3457117 | 0.97 | GBA1 (0.41) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| Ammonia Solution, Strong SCHEMBL10961064 | 0.94 | GBA1 (0.40) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL1707503 | 0.90 | TSHR (0.45) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL11140684 | 0.88 | TSHR (0.43) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL11139184 | 0.88 | TSHR (0.43) | TSHRALDH1A1TDP1GBA1CYP1A2 | |
| SCHEMBL1273487 | 0.88 | ALDH1A1 (0.41) | TSHRALDH1A1TDP1CYP1A2CA12 | |
| SCHEMBL24638059 | 0.87 | TSHR (0.52) | TSHRALDH1A1GBA1CYP1A2CYP2C19 | |
| SCHEMBL10744903 | 0.87 | TSHR (0.62) | TSHRALDH1A1CYP1A2CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6258976-B1 | COUPLING AN ISOCYANATE COMPOUND WITH AN AMINE | CHEM-MASTER INTERNATIONAL, INC. | 2001-07-10 | — | — | US | disclosed |