Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL457836 | 0.80 | TSHR (0.44) | TDP1TSHRHSD17B10ACHESMN1; SMN2 | |
| SCHEMBL301080 | 0.78 | TDP1 (0.34) | TDP1ATMALDH1A1HIF1AVCAM1 | |
| SCHEMBL27782172 | 0.77 | HSD17B10 (0.38) | TDP1TSHRHSD17B10ACHESMN1; SMN2 | |
| SCHEMBL9651909 | 0.77 | TDP1 (0.36) | TDP1TSHRHSD17B10ACHESMN1; SMN2 | |
| SCHEMBL2075135 | 0.72 | MAPT (0.36) | TDP1TSHRHSD17B10ATMSMN1; SMN2 | |
| SCHEMBL7822062 | 0.72 | ALDH1A1 (0.44) | TDP1TSHRHSD17B10SMN1; SMN2ALDH1A1 | |
| SCHEMBL7380148 | 0.72 | ALDH1A1 (0.37) | TDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL6037871 | 0.71 | TDP1 (0.38) | TDP1TSHRHSD17B10ACHEATM | |
| SCHEMBL7709814 | 0.69 | GPR35 (0.38) | TDP1TSHRHSD17B10ACHESMN1; SMN2 | |
| SCHEMBL29148497 | 0.69 | ALDH1A1 (0.32) | ALDH1A1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105949149-A | Compound for treatment or prevention of breast cancer | 江苏新元素医药科技有限公司 | 2016-09-21 | — | — | CN | disclosed |