Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL28302575 | 0.98 | TSHR (0.43) | TSHRNAPRTTDP1CYP2E1CYP3A4 | |
| Pyridine SCHEMBL28198537 | 0.95 | TSHR (0.41) | TSHRNAPRTTDP1CYP2E1CYP3A4 | |
| Pyridine SCHEMBL28271608 | 0.91 | TSHR (0.38) | TSHRNAPRTTDP1CYP2E1CYP3A4 | |
| Pyridine SCHEMBL28092021 | 0.89 | TSHR (0.36) | TSHRNAPRTTDP1CYP2E1CYP3A4 | |
| Ammonia Solution, Strong SCHEMBL27859174 | 0.78 | — | — | |
| Pyridine SCHEMBL28146823 | 0.78 | TBXAS1 (0.46) | TSHRNAPRTTDP1 | |
| Pyridine SCHEMBL28282092 | 0.75 | TSHR (0.45) | TSHRNAPRTTDP1 | |
| Pyridine SCHEMBL17504474 | 0.74 | — | — | |
| Pyridine SCHEMBL27955391 | 0.74 | TDP1 (0.69) | TSHRNAPRTTDP1 | |
| Pyridine SCHEMBL27871778 | 0.72 | TDP1 (0.64) | TSHRNAPRTTDP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110240603-A | A kind of new medicine use of thiophene [3,2-d] and pyrimidin-4-one class compound | 中国科学院上海药物研究所 | 2019-09-17 | — | — | CN | claimed |
| CN-110240603-A | A kind of new medicine use of thiophene [3,2-d] and pyrimidin-4-one class compound | 中国科学院上海药物研究所 | 2019-09-17 | — | — | CN | disclosed |
| CN-106256865-A | Surface protective film | 日东电工株式会社 | 2016-12-28 | — | — | CN | disclosed |
| CN-106256864-A | Surface protective film | 日东电工株式会社 | 2016-12-28 | — | — | CN | disclosed |
| CN-106165042-A | Electrical storage device | 住友电气工业株式会社 | 2016-11-23 | — | — | CN | disclosed |