Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 4/20 | 0.38 |
| ▸ | MMP9 | P14780 | 4/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30735904 | 0.83 | ATM (0.48) | ATMSIGMAR1ADRA1DADRA1AADRA1B | |
| SCHEMBL11387812 | 0.83 | ATM (0.48) | ATMSIGMAR1ADRA1DADRA1AADRA1B | |
| SCHEMBL28178430 | 0.82 | ATM (0.40) | ATMSIGMAR1MMP2MMP9MMP3 | |
| SCHEMBL28430170 | 0.81 | MMP2 (0.41) | ATMSIGMAR1MMP2MMP9MMP3 | |
| SCHEMBL27281276 | 0.80 | MMP2 (0.43) | ATMSIGMAR1MMP2MMP9MMP3 | |
| SCHEMBL6130741 | 0.78 | CYP2D6 (0.40) | MMP2MMP9MMP3MMP8MMP13 | |
| SCHEMBL2320079 | 0.76 | SIGMAR1 (0.46) | ATMSIGMAR1ADRA1DADRA1AADRA1B | |
| SCHEMBL28460053 | 0.76 | SIGMAR1 (0.41) | ATMSIGMAR1MMP2MMP9MMP3 | |
| SCHEMBL11386124 | 0.76 | AKT1 (0.46) | ATMSIGMAR1ADRA1DADRA1AADRA1B | |
| SCHEMBL6130758 | 0.73 | CYP2D6 (0.40) | MEN1KMT2ANPSR1CYP2C9CYP2C19 |
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-1104414-B1 | ENANTIOSELECTIVE SYNTHESIS | SCHERING CORP (US) | 2003-02-12 | — | — | EP | disclosed |