Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 13/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | ECE1 | P42892 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6203529 | 0.87 | TSHR (0.52) | PTPN1EPHX2KMT2ACHRM1ECE1 | |
| SCHEMBL27628032 | 0.82 | CHRM1 (0.60) | PTPN1EPHX2KMT2ACHRM1 | |
| SCHEMBL6203245 | 0.79 | PSMB5 (0.44) | PTPN1EPHX2 | |
| SCHEMBL27608839 | 0.78 | PTPN1 (0.57) | PTPN1PTPN2CHRM1 | |
| SCHEMBL27608908 | 0.77 | TSHR (0.49) | PTPN1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL6204076 | 0.77 | TSHR (0.49) | KMT2ACYP2C9CYP2C19 | |
| SCHEMBL4664796 | 0.76 | PPARA (0.56) | PTPN1EPHX2CYP2C9CYP2C19 | |
| SCHEMBL6203944 | 0.75 | EPHX1 (0.65) | PTPN1ATMPTPN2CHRM1 | |
| SCHEMBL4197953 | 0.74 | KCNA5 (0.50) | CYP2C9CYP2C19 | |
| SCHEMBL6201072 | 0.74 | TSHR (0.48) | PTPN1KMT2ACYP2C9CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| CN-1681763-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-10-12 | — | — | CN | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |