Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 4/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5745699 | 0.93 | TOP2A (0.45) | TOP2AMAOAHTR1BMAPTALDH1A1 | |
| SCHEMBL5747519 | 0.92 | MAOA (0.43) | TOP2AMAOAHTR1BMAPTALDH1A1 | |
| SCHEMBL5747968 | 0.87 | MAOA (0.45) | MAOAMAPTALDH1A1CYP3A4MEN1 | |
| SCHEMBL5745882 | 0.85 | MAOA (0.45) | TOP2AMAOAHTR1BMAPTALDH1A1 | |
| SCHEMBL5745622 | 0.82 | MAOA (0.47) | MAOAHTR1BMAPTALDH1A1CYP3A4 | |
| SCHEMBL5749002 | 0.81 | MAOA (0.56) | TOP2AMAOAHTR1BMEN1NPC1 | |
| SCHEMBL5747685 | 0.81 | MAOA (0.45) | TOP2AMAOAMAPTALDH1A1CYP3A4 | |
| SCHEMBL5749171 | 0.81 | XDH (0.57) | MAOAMAPTXDH | |
| SCHEMBL5748332 | 0.78 | XDH (0.51) | MAOAMAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL5748795 | 0.78 | HTR1B (0.58) | TOP2AMAOAHTR1BALDH1A1MEN1 |
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-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 |