Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | MMP2 | P08253 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | TERT | O14746 | 1/20 | 0.43 |
| ▸ | PARL | Q9H300 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP7 | P09237 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | MMP15 | P51511 | 1/20 | 0.41 |
| ▸ | MMP16 | P51512 | 1/20 | 0.41 |
| ▸ | MMP26 | Q9NRE1 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29620268 | 1.00 | ALDH1A1 (0.58) | ALDH1A1MMP2RAB9AKMT2ARECQL | |
| SCHEMBL1792211 | 0.85 | ALDH1A1 (0.50) | ALDH1A1MMP2RAB9AKMT2APARL | |
| SCHEMBL1571372 | 0.84 | ALDH1A1 (0.68) | ALDH1A1MMP2RAB9AKMT2AFAAH | |
| SCHEMBL31173291 | 0.84 | ALDH1A1 (0.71) | ALDH1A1MMP2RAB9AKMT2ATDP1 | |
| SCHEMBL1792200 | 0.84 | ALDH1A1 (0.71) | ALDH1A1MMP2RAB9AKMT2ATDP1 | |
| SCHEMBL17970868 | 0.83 | ALDH1A1 (0.62) | ALDH1A1MMP2RAB9AKMT2APSEN1 | |
| SCHEMBL17961617 | 0.83 | ALDH1A1 (0.62) | ALDH1A1MMP2RAB9AKMT2APSEN1 | |
| SCHEMBL1789530 | 0.80 | KMT2A (0.58) | ALDH1A1MMP2RAB9AKMT2ATDP1 | |
| SCHEMBL4298802 | 0.77 | MMP2 (0.46) | ALDH1A1MMP2KMT2ARECQLTDP1 | |
| SCHEMBL4298798 | 0.77 | MMP2 (0.46) | ALDH1A1MMP2KMT2ARECQLTDP1 |
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-112608269-B | Method for catalytically synthesizing pyrrolidine by weak interaction of chalcogen | 山东大学 | 2022-05-06 | — | — | CN | disclosed |
| CN-112608269-A | Method for catalytically synthesizing pyrrolidine by weak interaction of chalcogen | 山东大学 | 2021-04-06 | — | — | CN | disclosed |