Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 2/20 | 0.53 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CDC25A | P30304 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 1/20 | 0.40 |
| ▸ | CDC25C | P30307 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | BCL2 | P10415 | 1/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | BAD | Q92934 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5749087 | 0.93 | HTR1B (0.51) | HTR1BKCNA3ALDH1A1GLACDC25A | |
| SCHEMBL5747324 | 0.85 | HTR1B (0.58) | HTR1BKCNA3CDC25ACDC25BCDC25C | |
| SCHEMBL5746372 | 0.83 | MAOA (0.60) | HTR1BKCNA3ALDH1A1GLACYP2A6 | |
| SCHEMBL5746754 | 0.82 | HRH1 (0.56) | HTR1BKCNA3CDC25ACDC25BCDC25C | |
| SCHEMBL10652572 | 0.81 | CYP2A6 (0.55) | ALDH1A1CYP2A6MAOABCHEACHE | |
| SCHEMBL5748119 | 0.81 | HTR1B (0.55) | HTR1BALDH1A1CYP2A6MAOAKDM4E | |
| SCHEMBL5749229 | 0.80 | HTR1B (0.58) | HTR1BCDC25ACDC25BCDC25CCYP2A6 | |
| SCHEMBL5748123 | 0.79 | HTR1B (0.59) | HTR1BCDC25ACDC25BCDC25CCYP2A6 | |
| SCHEMBL10593907 | 0.75 | MAOA (0.66) | ALDH1A1CYP2A6MAOABCHEACHE | |
| SCHEMBL31241235 | 0.74 | BCHE (0.37) | ALDH1A1GLAMAOABCHEACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | claimed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | claimed |
| EP-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | disclosed |