Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | GCGR | P47871 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | PIM1 | P11309 | 2/20 | 0.45 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27966313 | 0.86 | HIF1A (0.52) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL27966332 | 0.85 | HPGD (0.66) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL28065241 | 0.81 | PANK3 (0.72) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL14662672 | 0.78 | HPGDS (0.47) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL2693403 | 0.77 | ACHE (0.63) | LMNAHDAC1HDAC6HDAC8HPGDS | |
| SCHEMBL27966499 | 0.77 | MAPT (0.59) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL14662186 | 0.76 | CTSA (0.69) | HPGDS | |
| SCHEMBL14662188 | 0.76 | CTSA (0.69) | HPGDS | |
| SCHEMBL26453259 | 0.75 | HPGD (0.63) | CYP1A2CYP3A4CYP2C9HPGDCYP2C19 | |
| SCHEMBL14662472 | 0.75 | CTSA (0.69) | — |
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-103827098-B | The 3-(thiazole-4-carbonyl)-replaced or 3-(thiazole-2-carbonyl)-alanine derivatives and the purposes as medicine thereof | 赛诺菲 | 2016-06-15 | — | — | CN | claimed |
| CN-103827098-B | The 3-(thiazole-4-carbonyl)-replaced or 3-(thiazole-2-carbonyl)-alanine derivatives and the purposes as medicine thereof | 赛诺菲 | 2016-06-15 | — | — | CN | disclosed |