Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.60 |
| ▸ | TSHR | P16473 | 5/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.56 |
| ▸ | GBA1 | P04062 | 4/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | STAT6 | P42226 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2156293 | 0.94 | TSHR (0.61) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14475581 | 0.93 | TSHR (0.63) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14475577 | 0.93 | TSHR (0.58) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14475111 | 0.88 | ALDH1A1 (0.62) | CYP1A2CYP3A4CYP2D6TSHRCLK4 | |
| SCHEMBL14475592 | 0.86 | ALDH1A1 (0.64) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14475563 | 0.84 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14474590 | 0.83 | MAPT (0.57) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14475227 | 0.83 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2D6TSHRTP53 | |
| SCHEMBL14727926 | 0.81 | ALDH1A1 (0.65) | CYP1A2CYP3A4CYP2D6TSHRCLK4 | |
| SCHEMBL14727935 | 0.81 | ALDH1A1 (0.59) | CYP1A2CYP3A4CYP2D6TSHRCLK4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102883723-B | Therapeutic compounds and related methods of use | OTSUKA PHARMACEUTICAL CO.,LTD. (JP) | 2015-09-16 | — | — | CN | disclosed |
| CN-102883723-A | Therapeutic compounds and related methods of use | GALENEA CORP | 2013-01-16 | — | — | CN | disclosed |