Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM6B | O15054 | 2/20 | 0.47 |
| ▸ | KDM4D | Q6B0I6 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KDM4A | O75164 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | ASPH | Q12797 | 1/20 | 0.46 |
| ▸ | RBP4 | P02753 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL379950 | 0.98 | POLB (0.54) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL29369561 | 0.98 | POLB (0.54) | POLBNPC1KDM4CMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL3827644 | 0.96 | POLB (0.52) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL3934372 | 0.87 | KDM4C (0.48) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL27743576 | 0.85 | NPC1 (0.55) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL28242959 | 0.84 | KDM4C (0.46) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL6220359 | 0.83 | NPC1 (0.43) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL115907 | 0.83 | KDM4C (0.53) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL15514535 | 0.83 | NPC1 (0.54) | POLBNPC1KDM4CMAPTALDH1A1 | |
| SCHEMBL30017034 | 0.83 | KDM4C (0.53) | POLBNPC1KDM4CMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114349690-B | Synthesis method of doravirine intermediate | 甘肃皓天医药科技有限责任公司 | 2023-04-25 | — | — | CN | claimed |
| CN-116425672-A | Preparation method of 2-chloro-3-fluoro-4- (trifluoromethyl) pyridine | 江西科宁科技有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-114349690-B | Synthesis method of doravirine intermediate | 甘肃皓天医药科技有限责任公司 | 2023-04-25 | — | — | CN | disclosed |
| CN-114349690-A | Synthesis method of dorawirin intermediate | 甘肃皓天医药科技有限责任公司 | 2022-04-15 | — | — | CN | disclosed |