Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29208309 | 0.86 | CYP26A1 (0.43) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL29208268 | 0.81 | MAOB (0.49) | RAB9AMEN1KMT2A | |
| SCHEMBL29208274 | 0.79 | CYP19A1 (0.42) | CA12CA1CA2CA9RAB9A | |
| SCHEMBL29208272 | 0.75 | CYP26A1 (0.45) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL11364004 | 0.75 | GAA (0.50) | TACR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL29208257 | 0.74 | MGLL (0.45) | TACR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL4424175 | 0.73 | DHODH (0.48) | TACR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28975793 | 0.71 | PIN1 (0.48) | RAB9AMEN1KMT2AHDAC3HDAC1 | |
| SCHEMBL27481741 | 0.71 | GAA (0.50) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL2948701 | 0.71 | TACR1 (0.51) | TACR1P2RY12NPC1RAB9AMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117964504-A | Preparation method of gem-difluoroallylglycine or polypeptide derivative | 南京林业大学 | 2024-05-03 | — | — | CN | disclosed |