Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 5/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9641085 | 0.76 | TSHR (0.45) | ALDH1A1KDM4ETSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL9640741 | 0.73 | HSD17B10 (0.39) | ALDH1A1TDP1KDM4EHPGDCYP1A2 | |
| SCHEMBL9641099 | 0.72 | MAPK1 (0.40) | ALDH1A1TDP1TSHRSMN1; SMN2CYP1A2 | |
| SCHEMBL17064165 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL2213466 | 0.68 | TDP1 (0.44) | ALDH1A1TDP1TSHRCYP3A4 | |
| SCHEMBL1013018 | 0.67 | ALDH1A1 (0.54) | ALDH1A1TDP1TSHRGRIN2DGRIN3B | |
| SCHEMBL29778851 | 0.67 | ALDH1A1 (0.54) | ALDH1A1TDP1TSHRGRIN2DGRIN3B | |
| SCHEMBL3192684 | 0.66 | ALDH1A1 (0.62) | ALDH1A1TDP1TSHRGRIN2DGRIN3B | |
| SCHEMBL16108546 | 0.65 | GRIN2D (0.41) | ALDH1A1TDP1TSHRGRIN2DGRIN3B | |
| Iodide SCHEMBL588864 | 0.64 | TSHR (0.35) | TSHRCYP2C9 |
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-5106407-A | Algicides, funcilides, bactericides | THE DOW CHEMICAL COMPANY (US) | 1992-04-21 | — | — | US | disclosed |