Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.44 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | POLA1 | P09884 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28795149 | 0.98 | ZDHHC7 (0.56) | ZDHHC7TSHRLCKPPARDZDHHC20 | |
| SCHEMBL28795333 | 0.94 | TSHR (0.46) | ZDHHC7TSHRLCKPPARDZDHHC20 | |
| SCHEMBL11456570 | 0.91 | ZDHHC7 (0.56) | ZDHHC7TSHRLCKPPARDZDHHC20 | |
| SCHEMBL9860092 | 0.91 | ZDHHC7 (0.56) | ZDHHC7TSHRLCKPPARDZDHHC20 | |
| SCHEMBL1040363 | 0.89 | TSHR (0.50) | ZDHHC7TSHRCA12CA14CA2 | |
| SCHEMBL18124155 | 0.87 | ZDHHC7 (0.51) | ZDHHC7TSHRLCKPPARDZDHHC20 | |
| SCHEMBL11371695 | 0.86 | TSHR (0.48) | ZDHHC7TSHRCA12CA14CA2 | |
| SCHEMBL10690002 | 0.85 | TSHR (0.50) | ZDHHC7TSHRCA12CA14POLB | |
| SCHEMBL7020332 | 0.81 | ZDHHC7 (0.58) | ZDHHC7LCKPPARDZDHHC20ZDHHC2 | |
| SCHEMBL11370272 | 0.80 | TSHR (0.50) | ZDHHC7TSHRCA12CA14CA2 |
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-114763356-B | Pyrrolo-benzodiazepine compound, and preparation method and application thereof | 沈阳药科大学 | 2023-06-20 | — | — | CN | disclosed |
| CN-114763356-A | Pyrrolobenzodiazepine compounds, and preparation method and application thereof | 沈阳药科大学 | 2022-07-19 | — | — | CN | disclosed |