Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | CDK9 | P50750 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL27764911 | 0.83 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL13674052 | 0.81 | CYP1A2 (0.63) | HSP90AA1HSP90AB1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3907740 | 0.76 | NPC1 (0.49) | ALDH1A1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL26091711 | 0.75 | HSP90AA1 (0.43) | HSP90AA1HSP90AB1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22078314 | 0.74 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1ALDH1A1CCNT1CDK9 | |
| SCHEMBL25516192 | 0.74 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1ALDH1A1CYP1A2CCNT1 | |
| SCHEMBL28985313 | 0.73 | TSHR (0.47) | ALDH1A1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL30263762 | 0.73 | TSHR (0.47) | ALDH1A1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL3908845 | 0.73 | RECQL (0.49) | ALDH1A1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL3912020 | 0.72 | CYP19A1 (0.51) | HSP90AA1ALDH1A1CDK9MEN1KMT2A |
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-102786439-A | Preparation method of 5-chloro-2-methoxy cyanophenyl | UNIV CHANGZHOU | 2012-11-21 | — | — | CN | disclosed |