Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ADH1B | P00325 | 1/20 | 0.41 |
| ▸ | ADH1C | P00326 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6325947 | 0.78 | RIPK1 (0.50) | THRBIDO1GAARIPK1CYP2C19 | |
| SCHEMBL2504732 | 0.76 | IDO1 (0.48) | THRBIDO1GAAKMT2AMEN1 | |
| SCHEMBL24965924 | 0.76 | RIPK1 (0.51) | THRBIDO1GAARIPK1CYP1A2 | |
| SCHEMBL28253091 | 0.74 | LMNA (0.44) | THRBIDO1GAARIPK1CYP1A2 | |
| SCHEMBL9302997 | 0.74 | RIPK1 (0.50) | THRBIDO1GAARIPK1CYP1A2 | |
| SCHEMBL22195174 | 0.74 | RIPK1 (0.50) | THRBIDO1GAARIPK1CYP1A2 | |
| Hydrochloric Acid SCHEMBL10481433 | 0.74 | RIPK1 (0.50) | THRBIDO1GAARIPK1KMT2A | |
| SCHEMBL14145021 | 0.74 | CYP3A4 (0.50) | THRBIDO1RIPK1KMT2ACYP2D6 | |
| SCHEMBL6703926 | 0.73 | THRB (0.42) | THRBIDO1GAARIPK1CYP1A2 | |
| SCHEMBL17822177 | 0.73 | LMNA (0.50) | THRBIDO1GAARIPK1CYP1A2 |
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-103333078-B | The synthetic method of a kind of anagrelide key intermediate, analogue or its salt | SUZHOU HUIHE PHARMACEUTICAL CO., LTD. (CN) | 2016-01-20 | — | — | CN | claimed |