Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6615449 | 0.89 | BCHE (0.42) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL6613756 | 0.83 | PADI4 (0.39) | BCHEACHEL3MBTL1KDM4ECYP3A4 | |
| SCHEMBL12615337 | 0.83 | BCHE (0.46) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL6616975 | 0.81 | BCHE (0.43) | BCHEACHEKMT2AMEN1KDM4E | |
| SCHEMBL6614465 | 0.77 | BCHE (0.37) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL6614727 | 0.77 | BCHE (0.37) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL6614414 | 0.73 | BCHE (0.34) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL6618224 | 0.73 | BCHE (0.38) | BCHEACHEKMT2AMEN1L3MBTL1 | |
| SCHEMBL15544356 | 0.73 | MAPT (0.63) | BCHEACHEKMT2AMEN1KDM4E | |
| SCHEMBL6647978 | 0.72 | KDM1A (0.34) | BCHEACHEL3MBTL1KDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1373203-A1 | CYCLOPROPYLINDOLE DERIVATIVES AS SELECTIVE SEROTONIN REUPTAKE INHIBITORS | Bristol-Myers Squibb Company (US) | 2004-01-02 | — | — | EP | disclosed |
| WO-2002079152-A1 | CYCLOPROPYLINDOLE DERIVATIVES AS SELECTIVE SEROTONIN REUPTAKE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-10-10 | — | — | WO | disclosed |