Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2980733 | 0.79 | PKM (0.36) | ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL27412775 | 0.77 | MAPT (0.41) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL770755 | 0.77 | CYP2C19 (0.39) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL1361079 | 0.77 | CYP2C19 (0.39) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL631049 | 0.76 | CYP2C19 (0.38) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL2053110 | 0.76 | CYP2C19 (0.38) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL26699486 | 0.76 | CYP2C19 (0.38) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL3181055 | 0.76 | CYP2C19 (0.38) | CYP2C19POLBTDP1MMP1MMP9 | |
| Ammonia Solution, Strong SCHEMBL16982684 | 0.76 | MAPT (0.40) | CYP2C19POLBTDP1MMP1MMP9 | |
| SCHEMBL28157325 | 0.76 | CYP2C19 (0.38) | CYP2C19POLBTDP1MMP1MMP9 |
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-103274989-B | The preparation method of octahydro cyclopentano [C] pyrrole derivative and salt thereof | NANJING LYNSCI CHEMICAL CO., LTD. (CN) | 2016-02-10 | — | — | CN | disclosed |
| CN-103274989-A | Preparation method of octahydrocyclopenta[C]pyrrole derivatives and salts thereof | NANJING LYNSCI CHEMICAL CO LTD | 2013-09-04 | — | — | CN | disclosed |