Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6881697 | 0.86 | TSHR (0.41) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL15874031 | 0.85 | TSHR (0.37) | TSHRGABRA1GABRB2HIF1AHPGD | |
| SCHEMBL27518770 | 0.85 | KDM4E (0.43) | TSHRG6PDCASP7CASP6BCHE | |
| SCHEMBL6880632 | 0.85 | TSHR (0.41) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL2198752 | 0.84 | TSHR (0.48) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL27511455 | 0.82 | TSHR (0.68) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL6884071 | 0.82 | TSHR (0.39) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL28261050 | 0.79 | TSHR (0.48) | TSHRGABRA1GABRB2G6PDCASP7 | |
| SCHEMBL5589704 | 0.79 | TSHR (0.52) | TSHRGABRA1GABRB2BCHETYR | |
| SCHEMBL1899229 | 0.79 | CD44 (0.43) | TSHRGABRA1CASP7TDP1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1442009-A1 | PRODUCTION OF KETO ACIDS | Ciba SC Holding AG (CH) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003037846-A1 | PRODUCTION OF KETO ACIDS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2003-05-08 | — | — | WO | disclosed |