Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.50 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.50 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11381869 | 0.81 | TDP1 (0.53) | TDP1ALDH1A1TSHRMAPK1HIF1A | |
| SCHEMBL27867862 | 0.81 | TDP1 (0.58) | TDP1ALDH1A1TSHRMAPK1HIF1A | |
| SCHEMBL3572666 | 0.81 | ALDH1A1 (0.60) | TDP1ALDH1A1TSHRGPR35SMN1; SMN2 | |
| SCHEMBL30168212 | 0.81 | ALDH1A1 (0.60) | TDP1ALDH1A1TSHRGPR35SMN1; SMN2 | |
| Methylsulfanylmethane SCHEMBL28744215 | 0.81 | TXNRD1 (0.50) | TDP1ALDH1A1TSHRMAPK1HIF1A | |
| SCHEMBL30142204 | 0.80 | HSD17B10 (0.58) | TDP1ALDH1A1TSHRMAPK1CYP3A4 | |
| SCHEMBL2815988 | 0.80 | ALDH1A1 (0.46) | TDP1ALDH1A1TSHRMAPK1HIF1A | |
| SCHEMBL30168161 | 0.80 | ALDH1A1 (0.46) | TDP1ALDH1A1TSHRMAPK1HIF1A | |
| SCHEMBL3586346 | 0.80 | ALDH1A1 (0.50) | TDP1ALDH1A1TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL4009365 | 0.80 | ATM (0.52) | TDP1ALDH1A1TSHRMAPK1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2119702-A1 | AMIDE DERIVATIVE | Dainippon Sumitomo Pharma Co., Ltd. (JP) | 2009-11-18 | — | — | EP | disclosed |