Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9359780 | 0.76 | PTPN1 (0.35) | IDO1PTPN1 | |
| SCHEMBL31410915 | 0.75 | IDO1 (0.32) | IDO1TRPA1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22504293 | 0.73 | PTPN1 (0.36) | PTPN1ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL7583136 | 0.73 | PTPN1 (0.36) | PTPN1ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL11797090 | 0.72 | PTPN1 (0.35) | IDO1PTPN1ALDH1A1CYP3A4 | |
| Methane SCHEMBL28757480 | 0.70 | PTPN1 (0.34) | IDO1PTPN1ALDH1A1CYP3A4 | |
| SCHEMBL15874145 | 0.70 | APLNR (0.39) | TRPA1PTPN1TSHRCYP2C19 | |
| SCHEMBL9715210 | 0.68 | GAA (0.36) | PTPN1ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL3262814 | 0.67 | CYP3A4 (0.40) | PTPN1ALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8994736 | 0.67 | CYP3A4 (0.40) | PTPN1ALDH1A1CYP3A4CYP2C9CYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101310716-A | Therapeutic agent | TAKARA BIO INC (JP) | 2008-11-26 | — | — | CN | claimed |
| CN-1791392-A | Therapeutic agents | TAKARA BIO INC (JP) | 2006-06-21 | — | — | CN | claimed |
| CN-103360324-B | New pyrimidine derivatives and the application in perfume compositions thereof | 国际香料和香精公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-101310716-A | Therapeutic agent | TAKARA BIO INC (JP) | 2008-11-26 | — | — | CN | disclosed |
| CN-100415218-C | Therapeutic agents | TAKARA BIO INC (JP) | 2008-09-03 | — | — | CN | disclosed |
| CN-1791392-A | Therapeutic agents | TAKARA BIO INC (JP) | 2006-06-21 | — | — | CN | disclosed |